 Entering Gaussian System, Link 0=g16
 Input=31_naproxen_conformer03_STD_B3LYPDBJ_def2SVPD.in
 Output=31_naproxen_conformer03_STD_B3LYPDBJ_def2SVPD.log
 AtFile(1): /user/pierpa/basis_sets/def2SVPD.gbs
            -H     0
            S    3   1.00
                 13.0107010              0.19682158D-01
                  1.9622572              0.13796524
                  0.44453796             0.47831935
            S    1   1.00
                  0.12194962             1.0000000
            P    1   1.00
                  0.8000000              1.0000000
            P    1   1.00
                  0.11704099050          1.0000000
            ****
            -He     0
            S    3   1.00
                 38.354936737            0.23814288905D-01
                  5.7689081479           0.15490906777
                  1.2399407035           0.46998096633
            S    1   1.00
                  0.29757815953          1.0000000
            P    1   1.00
                  1.0000000              1.0000000
            P    1   1.00
                  0.22039119441          1.0000000
            ****
            -Li     0
            S    5   1.00
                266.27785516             0.64920150325D-02
                 40.069783447            0.47747863215D-01
                  9.0559944389           0.20268796111
                  2.4503009051           0.48606574817
                  0.72209571855          0.43626977955
            S    1   1.00
                  0.52810884721D-01      1.0000000
            S    1   1.00
                  0.20960948798D-01      1.0000000
            P    2   1.00
                  1.4500000              0.2586000
                  0.3000000              1.0000000
            P    1   1.00
                  0.0820000              1.0000000
            P    1   1.00
                  0.26347662457D-01      1.0000000
            ****
            -Be     0
            S    5   1.00
                515.18616125             0.55615307983D-02
                 77.511037595            0.41190068062D-01
                 17.552481693            0.17913378108
                  4.8028940596           0.44736716455
                  1.4516214316           0.42009581920
            S    1   1.00
                  0.13281633620          1.0000000
            S    1   1.00
                  0.45837372213D-01      1.0000000
            P    3   1.00
                  3.6316917145          -0.29033998305D-01
                  0.71695694366         -0.16877854032
                  0.19541932860         -0.51403419628
            P    1   1.00
                  0.60515465890D-01      1.0000000
            P    1   1.00
                  0.30181880660D-01      1.0000000
            ****
            -B     0
            S    5   1.00
                839.31830086            -0.55929201074D-02
                126.26464843            -0.41565520771D-01
                 28.620600763           -0.18299816983
                  7.8793722710          -0.46540391866
                  2.4088857172          -0.44173884791
            S    1   1.00
                  0.25105109036          1.0000000
            S    1   1.00
                  0.83648866069D-01      1.0000000
            S    1   1.00
                  0.42351565332D-01      1.0000000
            P    3   1.00
                  6.0332223619          -0.35603672456D-01
                  1.2499157866          -0.19895775769
                  0.33871676350         -0.50850202618
            P    1   1.00
                  0.96415632351D-01      1.0000000
            D    1   1.00
                  0.5000000              1.0000000
            D    1   1.00
                  0.74392443101D-01      1.0000000
            ****
            -C     0
            S    5   1.00
               1238.4016938              0.54568832082D-02
                186.29004992             0.40638409211D-01
                 42.251176346            0.18025593888
                 11.676557932            0.46315121755
                  3.5930506482           0.44087173314
            S    1   1.00
                  0.40245147363          1.0000000
            S    1   1.00
                  0.13090182668          1.0000000
            S    1   1.00
                  0.67053540256D-01      1.0000000
            P    3   1.00
                  9.4680970621           0.38387871728D-01
                  2.0103545142           0.21117025112
                  0.54771004707          0.51328172114
            P    1   1.00
                  0.15268613795          1.0000000
            D    1   1.00
                  0.8000000              1.0000000
            D    1   1.00
                  0.11713185140          1.0000000
            ****
            -N     0
            S    5   1.00
               1712.8415853             -0.53934125305D-02
                257.64812677            -0.40221581118D-01
                 58.458245853           -0.17931144990
                 16.198367905           -0.46376317823
                  5.0052600809          -0.44171422662
            S    1   1.00
                  0.58731856571          1.0000000
            S    1   1.00
                  0.18764592253          1.0000000
            S    1   1.00
                  0.96171241529D-01      1.0000000
            P    3   1.00
                 13.571470233           -0.40072398852D-01
                  2.9257372874          -0.21807045028
                  0.79927750754         -0.51294466049
            P    1   1.00
                  0.21954348034          1.0000000
            D    1   1.00
                  1.0000000              1.0000000
            D    1   1.00
                  0.16697708112          1.0000000
            ****
            -O     0
            S    5   1.00
               2266.1767785             -0.53431809926D-02
                340.87010191            -0.39890039230D-01
                 77.363135167           -0.17853911985
                 21.479644940           -0.46427684959
                  6.6589433124          -0.44309745172
            S    1   1.00
                  0.80975975668          1.0000000
            S    1   1.00
                  0.25530772234          1.0000000
            S    1   1.00
                  0.76572453250D-01      1.0000000
            P    3   1.00
                 17.721504317            0.43394573193D-01
                  3.8635505440           0.23094120765
                  1.0480920883           0.51375311064
            P    1   1.00
                  0.27641544411          1.0000000
            P    1   1.00
                  0.69002276350D-01      1.0000000
            D    1   1.00
                  1.2000000              1.0000000
            D    1   1.00
                  0.17992024323          1.0000000
            ****
            -F     0
            S    5   1.00
               2894.8325990             -0.53408255515D-02
                435.41939120            -0.39904258866D-01
                 98.843328866           -0.17912768038
                 27.485198001           -0.46758090825
                  8.5405498171          -0.44653131020
            S    1   1.00
                  1.0654578038           1.0000000
            S    1   1.00
                  0.33247346748          1.0000000
            S    1   1.00
                  0.98097752264D-01      1.0000000
            P    3   1.00
                 22.696633924           -0.45212874436D-01
                  4.9872339257          -0.23754317067
                  1.3491613954          -0.51287353587
            P    1   1.00
                  0.34829881977          1.0000000
            P    1   1.00
                  0.83372148304D-01      1.0000000
            D    1   1.00
                  1.4000000              1.0000000
            D    1   1.00
                  0.22301361948          1.0000000
            ****
            -Ne     0
            S    5   1.00
               3598.9736625             -0.53259297003D-02
                541.32073112            -0.39817417969D-01
                122.90450062            -0.17914358188
                 34.216617022           -0.46893582977
                 10.650584124           -0.44782537577
            S    1   1.00
                  1.3545953960           1.0000000
            S    1   1.00
                  0.41919362639          1.0000000
            S    1   1.00
                  0.12055043545          1.0000000
            P    3   1.00
                 28.424053785           -0.46031944795D-01
                  6.2822510953          -0.23993183041
                  1.6978715079          -0.50871724964
            P    1   1.00
                  0.43300700172          1.0000000
            P    1   1.00
                  0.10141942051          1.0000000
            D    1   1.00
                  1.8880000              1.0000000
            D    1   1.00
                  0.28026803041          1.0000000
            ****
            -Na     0
            S    5   1.00
               4098.2003908             -0.58535911879D-02
                616.49374031            -0.43647161872D-01
                139.96644001            -0.19431465884
                 39.073441051           -0.48685065731
                 11.929847205           -0.41881705137
            S    3   1.00
                 20.659966030            0.85949689854D-01
                  1.9838860978          -0.56359144041
                  0.64836323942         -0.51954009048
            S    1   1.00
                  0.52443967404D-01      1.0000000
            S    1   1.00
                  0.28048160742D-01      1.0000000
            P    5   1.00
                 75.401862017            0.154353625324D-01
                 17.274818978            0.997382931840D-01
                  5.1842347425           0.312095939659
                  1.6601211973           0.492956748074
                  0.51232528958          0.324203983180
            P    1   1.00
                  0.0520000              1.0000000
            P    1   1.00
                  0.19853008514D-01      1.0000000
            D    1   1.00
                  0.1310000              1.0000000
            ****
            -Mg     0
            S    5   1.00
               4953.8339196             -0.57778967498D-02
                745.18044154            -0.43124761082D-01
                169.21604972            -0.19268216987
                 47.300672019           -0.48641439116
                 14.461336973           -0.42550894077
            S    3   1.00
                 24.768174789            0.87956969984D-01
                  2.4940945349          -0.55165058128
                  0.87807584533         -0.53443294833
            S    1   1.00
                  0.87212782497D-01      1.0000000
            S    1   1.00
                  0.33599293780D-01      1.0000000
            P    5   1.00
                 98.053010494           -0.14480564601D-01
                 22.586932277           -0.95495750787D-01
                  6.8391509842          -0.30787672651
                  2.2332843818          -0.49936292886
                  0.71606599387         -0.31503476213
            P    1   1.00
                  0.18914796195          1.0000000
            P    1   1.00
                  0.53768755187D-01      1.0000000
            P    1   1.00
                  0.23963578287D-01      1.0000000
            D    1   1.00
                  0.1010000              1.0000000
            ****
            -Al     0
            S    5   1.00
               5887.5727030              0.13483347987D-02
                885.61225996             0.10071576809D-01
                201.13604899             0.45132454056D-01
                 56.284974674            0.11461268043
                 17.229551243            0.10159608943
            S    3   1.00
                 29.340249922            0.69347454208D-01
                  3.0439630420          -0.42528117679
                  1.1285539518          -0.41449832210
            S    1   1.00
                  0.14234175160          1.0000000
            S    1   1.00
                  0.54400192313D-01      1.0000000
            S    1   1.00
                  0.32535359511D-01      1.0000000
            P    5   1.00
                145.11918809             0.63963373134D-02
                 33.717894833            0.44189359965D-01
                 10.369863083            0.15581575993
                  3.5135616036           0.28635286951
                  1.1980050273           0.22921423248
            P    1   1.00
                  0.26583005913          1.0000000
            P    1   1.00
                  0.71003361994D-01      1.0000000
            D    1   1.00
                  0.3000000              1.0000000
            D    1   1.00
                  0.53071685831D-01      1.0000000
            ****
            -Si     0
            S    5   1.00
               6903.7118686              0.13373962995D-02
               1038.4346419              0.99966546241D-02
                235.87581480             0.44910165101D-01
                 66.069385169            0.11463638540
                 20.247945761            0.10280063858
            S    3   1.00
                 34.353481730            0.70837285010D-01
                  3.6370788192          -0.43028836252
                  1.4002048599          -0.41382774969
            S    1   1.00
                  0.20484414805          1.0000000
            S    1   1.00
                  0.77994095468D-01      1.0000000
            S    1   1.00
                  0.46834778282D-01      1.0000000
            P    5   1.00
                179.83907373             0.61916656462D-02
                 41.907258846            0.43399431982D-01
                 12.955294367            0.15632019351
                  4.4383267393           0.29419996982
                  1.5462247904           0.23536823814
            P    1   1.00
                  0.35607612302          1.0000000
            P    1   1.00
                  0.10008513762          1.0000000
            D    1   1.00
                  0.3500000              1.0000000
            D    1   1.00
                  0.74117707708D-01      1.0000000
            ****
            -P     0
            S    5   1.00
               8002.4795106              0.57503489302D-02
               1203.6813590              0.43007628959D-01
                273.44227031             0.19363986252
                 76.655541517            0.49651693399
                 23.516927435            0.44983262479
            S    3   1.00
                 39.791683439            0.95188129789D-01
                  4.2770343323          -0.57649840368
                  1.6940256888          -0.54239583865
            S    1   1.00
                  0.27567674644          1.0000000
            S    1   1.00
                  0.10495590099          1.0000000
            S    1   1.00
                  0.64309734755D-01      1.0000000
            P    5   1.00
                219.50755823             0.92100565257D-02
                 51.274155030            0.65409765745D-01
                 15.921595892            0.24033730279
                  5.5069913481           0.46318321788
                  1.9537719426           0.37392563382
            P    1   1.00
                  0.47803397932          1.0000000
            P    1   1.00
                  0.13657952621          1.0000000
            D    1   1.00
                  0.4500000              1.0000000
            D    1   1.00
                  0.99587311089D-01      1.0000000
            ****
            -S     0
            S    5   1.00
               9184.9303010             -0.22294387756D-02
               1381.5105503             -0.16683029937D-01
                313.87147580            -0.75262436116D-01
                 88.053870623           -0.19376827038
                 27.039914905           -0.17718020803
            S    3   1.00
                 45.648731303           -0.10736062573
                  4.9664522326           0.65066293018
                  2.0116242047           0.59712155354
            S    1   1.00
                  0.35661077013          1.0000000
            S    1   1.00
                  0.13507221477          1.0000000
            S    1   1.00
                  0.44999823506D-01      1.0000000
            P    5   1.00
                261.98233439            -0.92729929822D-02
                 61.306894736           -0.66547669241D-01
                 19.103729887           -0.24828595903
                  6.6567720378          -0.48703847402
                  2.3959635161          -0.39337850312
            P    1   1.00
                  0.61776161679          1.0000000
            P    1   1.00
                  0.16993376871          1.0000000
            P    1   1.00
                  0.41706793676D-01      1.0000000
            D    1   1.00
                  0.5500000              1.0000000
            D    1   1.00
                  0.10172853717          1.0000000
            ****
            -Cl     0
            S    5   1.00
              10449.8275660              0.19708362484D-02
               1571.7365221              0.14754727977D-01
                357.12065523             0.66679112875D-01
                100.25185935             0.17228924084
                 30.812727554            0.15883786100
            S    3   1.00
                 51.923789434           -0.10009298909
                  5.7045760975           0.60841752753
                  2.3508376809           0.54352153355
            S    1   1.00
                  0.44605124672          1.0000000
            S    1   1.00
                  0.16848856190          1.0000000
            S    1   1.00
                  0.55344229413D-01      1.0000000
            P    5   1.00
                307.66790569            -0.87801484118D-02
                 72.102015515           -0.63563355471D-01
                 22.532680262           -0.24016428276
                  7.8991765444          -0.47798866557
                  2.8767268321          -0.38515850005
            P    1   1.00
                  0.77459363955          1.0000000
            P    1   1.00
                  0.21037699698          1.0000000
            P    1   1.00
                  0.50046271086D-01      1.0000000
            D    1   1.00
                  0.6500000              1.0000000
            D    1   1.00
                  0.12284803390          1.0000000
            ****
            -Ar     0
            S    5   1.00
              11797.1197650              0.20214479973D-02
               1774.3522753              0.15139852688D-01
                403.18875733             0.68525400873D-01
                113.24933999             0.17762929207
                 34.835298193            0.16496495001
            S    3   1.00
                 58.614775042           -0.10343394000
                  6.4922045078           0.63133365899
                  2.7117014403           0.54887572301
            S    1   1.00
                  0.54412974538          1.0000000
            S    1   1.00
                  0.20517411136          1.0000000
            S    1   1.00
                  0.66442487045D-01      1.0000000
            P    5   1.00
                356.28707256            -0.87321783271D-02
                 83.593132866           -0.63680317444D-01
                 26.186704029           -0.24311906886
                  9.2257275925          -0.48956069653
                  3.3922754954          -0.39229190040
            P    1   1.00
                  0.94740534010          1.0000000
            P    1   1.00
                  0.25659135062          1.0000000
            P    1   1.00
                  0.59491455142D-01      1.0000000
            D    1   1.00
                  0.6960000              1.0000000
            D    1   1.00
                  0.14309493859          1.0000000
            ****
            -K     0
            S    6   1.00
              31478.7467640              0.39838653994D-02
               4726.8876066              0.30501759762D-01
               1075.4345353              0.15073752622
                303.39811023             0.51912939801
                 98.327112831            1.0366957005
                 33.636222177            0.76398963199
            S    3   1.00
                 65.639209962           -0.28242617106
                  7.3162592218           1.6914935860
                  2.8902580135           1.2965331953
            S    3   1.00
                  4.5459748965          -0.76343555273D-02
                  0.70404124062          0.25635718960D-01
                  0.28266888959          0.16606859208D-01
            S    1   1.00
                  0.29058164020D-01      1.0000000
            S    1   1.00
                  0.12111638157D-01      1.0000000
            P    5   1.00
                361.22492154             0.20906479823D-01
                 84.670222166            0.15043641740
                 26.469088236            0.55440061077
                  9.2658077615           1.0409009991
                  3.3423388293           0.67825341194
            P    3   1.00
                  1.5100876104           0.75248191146
                  0.56568375163          1.3708585031
                  0.20817008495          0.66047633079
            P    1   1.00
                  0.0417370              1.0000000
            P    1   1.00
                  0.16603217986D-01      1.0000000
            D    1   1.00
                  0.3530000              1.0000000
            D    1   1.00
                  0.0980000              1.0000000
            ****
            -Ca     0
            S    6   1.00
              35138.7139290              0.39482520740D-02
               5276.4111348              0.30234243552D-01
               1200.4692589              0.14952019681
                338.71810542             0.51597345713
                109.85385922             1.0339510296
                 37.608880299            0.76937933526
            S    3   1.00
                 73.107977555           -0.28268525011
                  8.2407705688           1.6796092142
                  3.2959812993           1.2803766016
            S    3   1.00
                  5.2341800914          -0.76868604561D-02
                  0.84187220515          0.25382375978D-01
                  0.36510294029          0.16512171511D-01
            S    1   1.00
                  0.51222402884D-01      1.0000000
            S    1   1.00
                  0.19825111408D-01      1.0000000
            P    5   1.00
                413.11313893             0.20327135354D-01
                 96.935786224            0.14730276362
                 30.372154659            0.54887167322
                 10.684776830            1.0440659818
                  3.8821258350           0.68653490684
            P    3   1.00
                  1.7993016295           0.75410246871
                  0.69189056530          1.3409296599
                  0.26364024096          0.56391989435
            P    1   1.00
                  0.0749790              1.0000000
            P    1   1.00
                  0.23809355789D-01      1.0000000
            D    3   1.00
                  5.4979093879           0.73770011433D-01
                  1.3177128032           0.26052853169
                  0.32188682649          0.45233836380
            D    1   1.00
                  0.70528614919D-01      1.0000000
            ****
            -Sc     0
            S    6   1.00
              38956.0818040              0.39293205858D-02
               5849.5733637              0.30093221229D-01
               1330.8813154              0.14890370950
                375.55534165             0.51464282906
                121.87261370             1.0337708070
                 41.760243729            0.77436851627
            S    3   1.00
                 81.060633953           -0.28318552316
                  9.2059823972           1.6770806984
                  3.7063215732           1.2594733678
            S    3   1.00
                  5.9888909988          -0.77821367493D-02
                  0.97363432378          0.25499692745D-01
                  0.42041019223          0.16191560820D-01
            S    1   1.00
                  0.59440551913D-01      1.0000000
            S    1   1.00
                  0.22897806303D-01      1.0000000
            P    5   1.00
                466.31481262             0.19984300385D-01
                109.51217097             0.14561043072
                 34.375921827            0.54687466223
                 12.142096955            1.0479006012
                  4.4336767669           0.68894890327
            P    3   1.00
                  2.0971291866           0.75619214724
                  0.80977606956          1.3178212235
                  0.30834046588          0.54312268173
            P    1   1.00
                  0.0897480              1.0000000
            P    1   1.00
                  0.28148150384D-01      1.0000000
            D    4   1.00
                 19.240334928            0.27039082144D-01
                  5.1178995899           0.13803684743
                  1.6554278827           0.34869086403
                  0.54016355610          0.48594185717
            D    1   1.00
                  0.16211214518           .34374449689
            F    1   1.00
                  0.3450000              1.0000000
            ****
            -Ti     0
            S    6   1.00
              42961.5121850              0.39127635355D-02
               6450.9759169              0.29969820489D-01
               1467.7210915              0.14836352707
                414.20997355             0.51347285324
                134.48715840             1.0335365483
                 46.122209796            0.77854233930
            S    3   1.00
                 89.447762543           -0.28385401259
                 10.223346060            1.6772785333
                  4.1353774271           1.2411928456
            S    3   1.00
                  6.7896181452          -0.78399994518D-02
                  1.1106730691           0.25495493019D-01
                  0.47565975578          0.16061172892D-01
            S    1   1.00
                  0.65986956934D-01      1.0000000
            S    1   1.00
                  0.25210342250D-01      1.0000000
            P    5   1.00
                522.03684782             0.19754179642D-01
                122.68649489             0.14460677619
                 38.572903611            0.54669004165
                 13.672169319            1.0531647540
                  5.0118529359           0.69111213363
            P    3   1.00
                  2.4131928282           0.75803437136
                  0.93252270050          1.3036241399
                  0.35429058390          0.53638653300
            P    1   1.00
                  0.1015610              1.0000000
            P    1   1.00
                  0.35788253200D-01      1.0000000
            D    4   1.00
                 23.465125957            0.26536380115D-01
                  6.3332593832           0.13796453963
                  2.0766489946           0.35312644228
                  0.69027361954          0.48647124166
            D    1   1.00
                  0.21088738554           .33026314258
            F    1   1.00
                  0.5620000              1.0000000
            ****
            -V     0
            S    6   1.00
              47160.3760600              0.14498688908D-02
               7081.4110871              0.11106435251D-01
               1611.1621223              0.55005423585D-01
                454.72940551             0.19060252591
                147.71321208             0.38435022957
                 50.699538950            0.29095546792
            S    3   1.00
                 98.262492669           -0.10942337856
                 11.294293099            0.64539490399
                  4.5853360105           0.47117880777
            S    3   1.00
                  7.6359689588          -0.22454949054
                  1.2539836689           0.72594852764
                  0.53271935387          0.45560582748
            S    1   1.00
                  0.72246239566D-01      1.0000000
            S    1   1.00
                  0.27358087448D-01      1.0000000
            P    5   1.00
                580.55044988             0.97315110917D-02
                136.52341127             0.71531241137D-01
                 42.983958820            0.27197688414
                 15.282798763            0.52618988893
                  5.6202495154           0.34452533498
            P    3   1.00
                  2.7485386415           0.34040396496
                  1.0618550073           0.57983996120
                  0.40235518645          0.23911643083
            P    1   1.00
                  0.1112480              1.0000000
            P    1   1.00
                  0.35000888460D-01      1.0000000
            D    4   1.00
                 27.358434017            0.26641927050D-01
                  7.4540604253           0.13995311726
                  2.4633917847           0.35751066639
                  0.82480925277          0.48488354148
            D    1   1.00
                  0.25257904742           .32332844995
            F    1   1.00
                  0.8310000              1.0000000
            ****
            -Cr     0
            S    6   1.00
              51528.0863490              0.14405823106D-02
               7737.2103487              0.11036202287D-01
               1760.3748470              0.54676651806D-01
                496.87706544             0.18965038103
                161.46520598             0.38295412850
                 55.466352268            0.29090050668
            S    3   1.00
                107.54732999            -0.10932281100
                 12.408671897            0.64472599471
                  5.0423628826           0.46262712560
            S    3   1.00
                  8.5461640165          -0.22711013286
                  1.3900441221           0.73301527591
                  0.56066602876          0.44225565433
            S    1   1.00
                  0.71483705972D-01      1.0000000
            S    1   1.00
                  0.28250687604D-01      1.0000000
            P    5   1.00
                640.48536096             0.96126715203D-02
                150.69711194             0.70889834655D-01
                 47.503755296            0.27065258990
                 16.934120165            0.52437343414
                  6.2409680590           0.34107994714
            P    3   1.00
                  3.0885463206           0.33973986903
                  1.1791047769           0.57272062927
                  0.43369774432          0.24582728206
            P    1   1.00
                  0.1206750              1.0000000
            P    1   1.00
                  0.33978554488D-01      1.0000000
            D    4   1.00
                 27.559479426            0.30612488044D-01
                  7.4687020327           0.15593270944
                  2.4345903574           0.36984421276
                  0.78244754808          0.47071118077
            D    1   1.00
                  0.21995774311           .33941649889
            F    1   1.00
                  1.1470000              1.0000000
            ****
            -Mn     0
            S    6   1.00
              56137.0090370              0.14321304702D-02
               8429.2063943              0.10972509162D-01
               1917.8277233              0.54382468712D-01
                541.36230198             0.18884335129
                176.00069142             0.38198025054
                 60.500477010            0.29156772596
            S    3   1.00
                117.17282882            -0.10933661328
                 13.596973368            0.64305039431
                  5.5483996341           0.45848970584
            S    3   1.00
                  9.4662853530          -0.22538977259
                  1.5595006070           0.72307758657
                  0.65230205868          0.45300721536
            S    1   1.00
                  0.84003734475D-01      1.0000000
            S    1   1.00
                  0.31256098581D-01      1.0000000
            P    5   1.00
                706.00497535             0.95055518167D-02
                166.19728820             0.70356271142D-01
                 52.452061906            0.27005556982
                 18.746932862            0.52574344602
                  6.9282991622           0.34254033223
            P    3   1.00
                  3.4772204938           0.33994073736
                  1.3406906449           0.57203836254
                  0.50498803038          0.23847605831
            P    1   1.00
                  0.1276500              1.0000000
            P    1   1.00
                  0.36336999053D-01      1.0000000
            D    4   1.00
                 35.423264935            0.26985304111D-01
                  9.7814221451           0.14383458648
                  3.2673488767           0.36418958377
                  1.1026472189           0.48152670661
            D    1   1.00
                  0.33743205934           .31458754360
            F    1   1.00
                  1.3260000              1.0000000
            ****
            -Fe     0
            S    6   1.00
              60923.6406430              0.14302254466D-02
               9147.8893982              0.10958790038D-01
               2081.3505927              0.54332554248D-01
                587.55977067             0.18884995009
                191.09043990             0.38253069946
                 65.732730112            0.29308335984
            S    3   1.00
                127.25891928            -0.10964564925
                 14.830913010            0.64387631332
                  6.0653307408           0.45472347323
            S    3   1.00
                 10.449943710           -0.22539639952
                  1.7245228003           0.72164398156
                  0.71772177325          0.44985492922
            S    1   1.00
                  0.91449828308D-01      1.0000000
            S    1   1.00
                  0.33706691021D-01      1.0000000
            P    5   1.00
                773.43750995             0.94325735144D-02
                182.15149714             0.70029620575D-01
                 57.547272758            0.26993651996
                 20.614988935            0.52700011047
                  7.6348557890           0.34284148028
            P    3   1.00
                  3.8719327990           0.33974402988
                  1.4924724132           0.56842594005
                  0.56061284958          0.23649365839
            P    1   1.00
                  0.1349150              1.0000000
            P    1   1.00
                  0.36933633962D-01      1.0000000
            D    4   1.00
                 38.968133419            0.27879664382D-01
                 10.800067078            0.14858319982
                  3.6136457999           0.36905479496
                  1.2129967888           0.47745100883
            D    1   1.00
                  0.36524393170           .31418142304
            F    1   1.00
                  1.5980000              1.0000000
            ****
            -Co     0
            S    6   1.00
              65902.2082570              0.14284614936D-02
               9895.3896027              0.10946072783D-01
               2251.4305789              0.54285953890D-01
                635.61097084             0.18885179079
                206.78820681             0.38301634994
                 71.179242971            0.29443551266
            S    3   1.00
                137.77268040            -0.10990221736
                 16.118079243            0.64455537395
                  6.6030327710           0.45116787924
            S    3   1.00
                 11.479915788           -0.22593846910
                  1.8956426324           0.72231409008
                  0.78466232067          0.44903812296
            S    1   1.00
                  0.98425774432D-01      1.0000000
            S    1   1.00
                  0.35945741932D-01      1.0000000
            P    5   1.00
                843.64358575             0.93866097254D-02
                198.76386994             0.69880208716D-01
                 62.854963098            0.27037070345
                 22.562842280            0.52904786880
                  8.3713209127           0.34357029579
            P    3   1.00
                  4.2858719800           0.34027999036
                  1.6508041817           0.56693392384
                  0.61834231096          0.23617979783
            P    1   1.00
                  0.1413080              1.0000000
            P    1   1.00
                  0.37744197011D-01      1.0000000
            D    4   1.00
                 42.927867612            0.28487788365D-01
                 11.942533053            0.15206951283
                  4.0046495664           0.37310913999
                  1.3413193804           0.47549837676
            D    1   1.00
                  0.40015009743           .31346831424
            F    1   1.00
                  1.9030000              1.0000000
            ****
            -Ni     0
            S    6   1.00
              71074.8032110              0.14260386729D-02
              10672.0209410              0.10928236994D-01
               2428.1389007              0.54212626938D-01
                685.53595148             0.18874768902
                223.10072863             0.38324616985
                 76.842014042            0.29550637144
            S    3   1.00
                148.71122016            -0.11014443059
                 17.459154987            0.64521426988
                  7.1625280665           0.44797838103
            S    3   1.00
                 12.556137125           -0.22645403224
                  2.0735740488           0.72320959286
                  0.85382640602          0.44868026476
            S    1   1.00
                  0.10536766271          1.0000000
            S    1   1.00
                  0.38134087688D-01      1.0000000
            P    5   1.00
                916.73608662             0.93439635610D-02
                216.06139913             0.69737374902D-01
                 68.383914817            0.27073495012
                 24.593843952            0.53078301549
                  9.1392960204           0.34410229438
            P    3   1.00
                  4.7193371746           0.34076082016
                  1.8161849234           0.56580169611
                  0.67840750720          0.23616717361
            P    1   1.00
                  0.1465880              1.0000000
            P    1   1.00
                  0.38905548722D-01      1.0000000
            D    4   1.00
                 47.093832108            0.28982316948D-01
                 13.146463975            0.15494995950
                  4.4170548925           0.37633115111
                  1.4771565078           0.47365096014
            D    1   1.00
                  0.43735921792           .31247837833
            F    1   1.00
                  2.1740000              1.0000000
            ****
            -Cu     0
            S    6   1.00
              76381.3480560              0.14336079896D-02
              11468.7774990              0.10986749865D-01
               2609.4246495              0.54513652465D-01
                736.75033098             0.18990128258
                239.82419958             0.38581959211
                 82.656829252            0.29790607498
            S    3   1.00
                160.13544196            -0.11146778567
                 18.834177695            0.65349301031
                  7.7176595741           0.44770534421
            S    3   1.00
                 13.710846717           -0.22870911122
                  2.2349895670           0.73464423031
                  0.87818360069          0.43273070874
            S    1   1.00
                  0.87187458064D-01      1.0000000
            S    1   1.00
                  0.32969114665D-01      1.0000000
            P    5   1.00
                991.24075782             0.93878498798D-02
                233.69376116             0.70208282458D-01
                 74.020930927            0.27323522220
                 26.664967447            0.53580792728
                  9.9192087478           0.34575794906
            P    3   1.00
                  5.1519553926           0.34229108083
                  1.9638205828           0.56456592484
                  0.71560097037          0.24078584318
            P    1   1.00
                  0.1550650              1.0000000
            P    1   1.00
                  0.38734214974D-01      1.0000000
            D    4   1.00
                 47.335049590            0.32375547758D-01
                 13.161666077            0.16810218684
                  4.3693777244           0.38477707982
                  1.4132925109           0.46147880178
            D    1   1.00
                  0.38878001452           .32388873258
            F    1   1.00
                  2.2330000              1.0000000
            ****
            -Zn     0
            S    6   1.00
              82000.7116290              0.14210764000D-02
              12312.4717770              0.10891499487D-01
               2801.3944193              0.54057188059D-01
                790.99424302             0.18847463904
                257.56551079             0.38346549346
                 88.814933400            0.29723794197
            S    3   1.00
                171.86353716            -0.11051849523
                 20.302534785            0.64607716984
                  8.3464123068           0.44220117322
            S    3   1.00
                 14.847536940           -0.22705309278
                  2.4495029507           0.72433217935
                  0.99845821824          0.44836495592
            S    1   1.00
                  0.11891307937          1.0000000
            S    1   1.00
                  0.42297428760D-01      1.0000000
            P    5   1.00
               1071.5185372              0.92767797235D-02
                252.69712152             0.69541149434D-01
                 80.100829126            0.27156772564
                 28.903393172            0.53401355573
                 10.768899879            0.34501323446
            P    3   1.00
                  5.6446212530           0.34129600164
                  2.1678291347           0.56390521973
                  0.80540898341          0.23676109735
            P    1   1.00
                  0.1624550              1.0000000
            P    1   1.00
                  0.42022716037D-01      1.0000000
            D    4   1.00
                 56.088939191            0.29588869140D-01
                 15.751908917            0.158725714045
                  5.3115812367           0.379762291591
                  1.7737904917           0.468989591719
            D    1   1.00
                  0.51975583665           .309071490776
            F    1   1.00
                  2.6140000              1.0000000
            ****
            -Ga     0
            S    6   1.00
              87842.1262960              0.14271588798D-02
              13189.4964020              0.10938894097D-01
               3000.9482141              0.54308200127D-01
                847.38425966             0.18951055983
                276.00980642             0.38615185918
                 95.216672071            0.30051082719
            S    3   1.00
                184.00703968            -0.11124461963
                 21.827051433            0.64831322918
                  9.0026963761           0.44358383594
            S    3   1.00
                 16.033176938           -0.23014299555
                  2.6707724878           0.72946861516
                  1.1252834170           0.46214976951
            S    1   1.00
                  0.15967608829          1.0000000
            S    1   1.00
                  0.57643044753D-01      1.0000000
            S    1   1.00
                  0.31819812628D-01      1.0000000
            P    5   1.00
               1167.2665844              0.90974021307D-02
                275.38062789             0.68456273343D-01
                 87.375073070            0.26922293888
                 31.597254670            0.53507897882
                 11.824122798            0.35279062760
            P    3   1.00
                  6.2881845133           0.33938244530
                  2.5199853240           0.56871947608
                  1.0169726306           0.27717694939
            P    1   1.00
                  0.24748373604          1.0000000
            P    1   1.00
                  0.66685294163D-01      1.0000000
            D    4   1.00
                 65.354237674            0.27370146382D-01
                 18.504656747            0.15099463976
                  6.3179620632           0.37485328545
                  2.1641389426           0.47510606851
            D    1   1.00
                  0.66693092754           .29843287401
            D    1   1.00
                  0.2070000              1.0000000
            D    1   1.00
                  0.49799390975D-01      1.0000000
            ****
            -Ge     0
            S    6   1.00
              93889.8366420              0.14233976060D-02
              14097.4975280              0.10910795654D-01
               3207.5477309              0.54183705943D-01
                905.76727269             0.18922820349
                295.11014693             0.38612847001
                101.84713141             0.30164050736
            S    3   1.00
                196.56719662            -0.11118770940
                 23.405292522            0.64616007369
                  9.6839116702           0.44188904568
            S    3   1.00
                 17.269736544           -0.23027421375
                  2.8964622160           0.73017169398
                  1.2553621412           0.46197222255
            S    1   1.00
                  0.20213081492          1.0000000
            S    1   1.00
                  0.73867910982D-01      1.0000000
            S    1   1.00
                  0.43410224935D-01      1.0000000
            P    5   1.00
               1259.2085995              0.90115464252D-02
                297.15626382             0.67986841689D-01
                 94.353387522            0.26853856488
                 34.176329677            0.53659649219
                 12.816139615            0.35633514961
            P    3   1.00
                  6.8471029784           0.33900693119
                  2.7717363939           0.56809365264
                  1.1458418175           0.27246539884
            P    1   1.00
                  0.30679631536          1.0000000
            P    1   1.00
                  0.89283644115D-01      1.0000000
            D    4   1.00
                 74.782168177            0.25755860205D-01
                 21.310849759            0.14536816132
                  7.3464792363           0.37134209859
                  2.5656271395           0.48002998436
            D    1   1.00
                  0.81981773070           .28978790744
            D    1   1.00
                  0.2460000              1.0000000
            D    1   1.00
                  0.66328328796D-01      1.0000000
            ****
            -As     0
            S    6   1.00
             100146.5255400              0.14258349617D-02
              15036.8617110              0.10930176963D-01
               3421.2902833              0.54294174610D-01
                966.16965717             0.18976078153
                314.87394026             0.38775195453
                108.70823790             0.30402812040
            S    3   1.00
                209.54238950            -0.11162094204
                 25.038221139            0.64697607762
                 10.390964343            0.44223608673
            S    3   1.00
                 18.555090093           -0.22994190569
                  3.1281217449           0.73319107613
                  1.3884885073           0.45533653943
            S    1   1.00
                  0.24714362141          1.0000000
            S    1   1.00
                  0.91429428670D-01      1.0000000
            S    1   1.00
                  0.55939685220D-01      1.0000000
            P    5   1.00
               1355.6443507              0.89182507898D-02
                319.99929270             0.67454750717D-01
                101.67734092             0.26759772110
                 36.886323845            0.53776844520
                 13.861115909            0.35992570244
            P    3   1.00
                  7.4260666912           0.34036849637
                  3.0316247187           0.57030149334
                  1.2783078340           0.26606170238
            P    1   1.00
                  0.37568503356          1.0000000
            P    1   1.00
                  0.11394805454          1.0000000
            D    4   1.00
                 84.445514539            0.24518402724D-01
                 24.190416102            0.14107454677
                  8.4045015119           0.36875228915
                  2.9808970748           0.48409561362
            D    1   1.00
                  0.97909243359           .28250268781
            D    1   1.00
                  0.2930000              1.0000000
            D    1   1.00
                  0.84097628016D-01      1.0000000
            ****
            -Se     0
            S    6   1.00
             106612.2002700              0.14274889113D-02
              16007.6047010              0.10943525114D-01
               3642.1699707              0.54374171596D-01
               1028.5912993              0.19018092947
                335.30298888             0.38913021696
                115.80129154             0.30620207088
            S    3   1.00
                222.93325020            -0.11198808009
                 26.726257934            0.64752124207
                 11.124501923            0.44241976651
            S    3   1.00
                 19.888520061           -0.22857227762
                  3.3668473803           0.73591359951
                  1.5249277839           0.44330199577
            S    1   1.00
                  0.29630037912          1.0000000
            S    1   1.00
                  0.11009288974          1.0000000
            S    1   1.00
                  0.42167294728D-01      1.0000000
            P    5   1.00
               1455.9068120              0.88203597043D-02
                343.75101831             0.66875851967D-01
                109.29554964             0.26640578080
                 39.707711022            0.53834928422
                 14.950185232            0.36303281993
            P    3   1.00
                  8.0208962094           0.34153807025
                  3.2934649756           0.57257906583
                  1.4058602438           0.25549813222
            P    1   1.00
                  0.45076123226          1.0000000
            P    1   1.00
                  0.13353413325          1.0000000
            P    1   1.00
                  0.34396697938D-01      1.0000000
            D    4   1.00
                 94.494024044            0.23490101098D-01
                 27.188185260            0.13747735767D+00
                  9.5091567352           0.36649929124D+00
                  3.4170516853           0.48750989884D+00
            D    1   1.00
                  1.1479590083            .27657943383D+00
            D    1   1.00
                  0.3380000              1.0000000
            D    1   1.00
                  0.82767380906D-01      1.0000000
            ****
            -Br     0
            S    6   1.00
             113286.3877600              0.14283037779D-02
              17009.6263030              0.10950417496D-01
               3870.1842567              0.54421006604D-01
               1093.0357227              0.19047907695
                356.39721797             0.39024642737
                123.12539643             0.30814432514
            S    3   1.00
                236.74084007            -0.11228065671
                 28.468661070            0.64775962312
                 11.883443722            0.44235575986
            S    3   1.00
                 21.269633312           -0.22642576323
                  3.6129226841           0.73823712008
                  1.6626648969           0.42683868694
            S    1   1.00
                  0.34823793232          1.0000000
            S    1   1.00
                  0.13019031394          1.0000000
            S    1   1.00
                  0.50966709763D-01      1.0000000
            P    5   1.00
               1560.2801881              0.87166669072D-02
                368.47859205             0.66243637420D-01
                117.22978849             0.26495610385
                 42.648909248            0.53839160587
                 16.087225096            0.36579387888
            P    3   1.00
                  8.6352810058           0.34248787366
                  3.5613665502           0.57500678213
                  1.5292626609           0.24330394172
            P    1   1.00
                  0.53064294848          1.0000000
            P    1   1.00
                  0.15702758965          1.0000000
            P    1   1.00
                  0.39636841846D-01      1.0000000
            D    4   1.00
                104.85518642             0.22650147581D-01
                 30.281143688            0.13455483230
                 10.651394267            0.36474454537
                  3.8699456233           0.49044587056
            D    1   1.00
                  1.3240876762            .27137289040
            D    1   1.00
                  0.3890000              1.0000000
            D    1   1.00
                  0.96543342393D-01      1.0000000
            ****
            -Kr     0
            S    6   1.00
             120165.6487500              0.14294234496D-02
              18042.5001690              0.10959597020D-01
               4105.1800388              0.54479647470D-01
               1159.4447248              0.19081239122
                378.13810346             0.39140445949
                130.67610045             0.31007346689
            S    3   1.00
                250.96373353            -0.11258604011
                 30.265930380            0.64816322524
                 12.668110757            0.44240238994
            S    3   1.00
                 22.697940101           -0.22391964908
                  3.8673017398           0.74060953026
                  1.8013706671           0.40803658445
            S    1   1.00
                  0.40308639136          1.0000000
            S    1   1.00
                  0.15170527749          1.0000000
            S    1   1.00
                  0.60450731670D-01      1.0000000
            P    5   1.00
               1668.5736623              0.86215009803D-02
                394.13862798             0.65665506884D-01
                125.46644854             0.26366576697
                 45.704992729            0.53867658574
                 17.270133229            0.36865167502
            P    3   1.00
                  9.2699487770           0.34346189015
                  3.8364617719           0.57784776196
                  1.6467163312           0.23075615197
            P    1   1.00
                  0.61479686489          1.0000000
            P    1   1.00
                  0.18319467414          1.0000000
            P    1   1.00
                  0.45792563991D-01      1.0000000
            D    4   1.00
                115.55868603             0.21945485333D-01
                 33.477985864            0.13211212879
                 11.834450207            0.36333306964
                  4.3408254894           0.49300484446
            D    1   1.00
                  1.5079273157            .26676858913
            D    1   1.00
                  0.4430000              1.0000000
            D    1   1.00
                  0.11235044486          1.0000000
            ****
            -Rb     0
            S    3   1.00
                  4.6687885071           0.29008526793
                  2.9442428420          -0.67740090428
                  0.58171262989          0.45712389487
            S    1   1.00
                  0.45147933555          1.0000000
            S    1   1.00
                  0.21604923532          1.0000000
            S    1   1.00
                  0.32088816526D-01      1.0000000
            S    1   1.00
                  0.13833878175D-01      1.0000000
            P    4   1.00
                  5.5234179480           0.51234729472D-01
                  3.4120149646          -0.17337025646
                  0.76899021792          0.43339683188
                  0.33088071786          0.55354332721
            P    1   1.00
                  0.13423268441          1.0000000
            P    1   1.00
                  0.20642679613D-01      1.0000000
            P    1   1.00
                  0.43243763156D-02      1.0000000
            D    1   1.00
                  0.2260000              1.0000000
            D    1   1.00
                  0.27432280711D-01      1.0000000
            ****
            -Sr     0
            S    3   1.00
                  5.9276428767           0.19698765364
                  3.0691274814          -0.64852205985
                  0.70675488028          0.62064729022
            S    1   1.00
                  0.33824024280          1.0000000
            S    1   1.00
                  0.61768869200D-01      1.0000000
            S    1   1.00
                  0.25767593093D-01      1.0000000
            P    4   1.00
                  2.4324720000          -0.37145059848
                  1.6642340000           0.37856824234
                  0.59455471858          0.59874487803
                  0.26152621998          0.35314019512
            P    1   1.00
                  0.10258814042          1.0000000
            P    1   1.00
                  0.33223404030D-01      1.0000000
            P    1   1.00
                  0.16570352270D-01      1.0000000
            D    4   1.00
                  3.6180810000          -0.75010000000D-02
                  0.99665600000          0.10809800000
                  0.39073500000          0.27854000000
                  0.12277000000          0.47731800000
            D    1   1.00
                  0.36655000000D-01       .44818300000
            ****
            -Y     0
            S    3   1.00
                  5.1329580000          -1.3864845457
                  4.2401920000           1.9459581166
                  1.2982800000           0.44182603154
            S    1   1.00
                  0.82904954347          1.0000000
            S    1   1.00
                  0.34752758911          1.0000000
            S    1   1.00
                  0.68418878574D-01      1.0000000
            S    1   1.00
                  0.27323992904D-01      1.0000000
            P    4   1.00
                  2.7279200000          -0.37249884911871
                  1.9790500000           0.32572065995957
                  0.79980886805          0.50094655502482
                  0.38409397354          0.44385929492812
            P    1   1.00
                  0.16173582264          1.0000000
            P    1   1.00
                  0.69700000000D-01      1.0000000
            P    1   1.00
                  0.0300000              1.0000000
            D    4   1.00
                  3.9030833060          -0.0098209792625124
                  1.1363234302           0.19183629664092
                  0.45617043877          0.40597788538820
                  0.17470950748          0.43861485518224
            D    1   1.00
                  0.61978796638D-01      1.0000000
            F    1   1.00
                  0.2651500              1.0000000
            ****
            -Zr     0
            S    3   1.00
                  5.8737890000           0.54255558714
                  4.2872700000          -0.95241333244
                  1.4641370000          -0.13703926411
            S    1   1.00
                  0.83727682345           .88521584390
            S    1   1.00
                  0.36849806511          1.0000000
            S    1   1.00
                  0.77806859124D-01      1.0000000
            S    1   1.00
                  0.30273088330D-01      1.0000000
            P    4   1.00
                  2.8742240000          -0.46624086918
                  2.1199010000           0.45883133891
                  0.78845821105          0.58853912475
                  0.36332579847          0.35822232244
            P    1   1.00
                  0.14951762021          1.0000000
            P    1   1.00
                  0.67000000000D-01      1.0000000
            P    1   1.00
                  0.30000000000D-01      1.0000000
            D    4   1.00
                  4.2898623878          -0.12212868080D-01
                  1.3615557498           0.19692423520
                  0.56937550689          0.42057831659
                  0.22674948677          0.42757027999
            D    1   1.00
                  0.83011031631D-01      1.0000000
            F    1   1.00
                  0.3926100              1.0000000
            ****
            -Nb     0
            S    3   1.00
                  6.5663010000          -0.94917907866
                  4.5864380000           1.5736372883
                  3.7537700000           0.36380422981
            S    1   1.00
                  0.84187717437          1.0000000
            S    1   1.00
                  0.38160666177          1.0000000
            S    1   1.00
                  0.85819911368D-01      1.0000000
            S    1   1.00
                  0.32702330370D-01      1.0000000
            P    4   1.00
                  3.0700630000          -0.51025115881
                  2.2379640000           0.53570598017
                  0.80801969671          0.63102216351
                  0.35783343432          0.30205908942
            P    1   1.00
                  0.13820085283          1.0000000
            P    1   1.00
                  0.70500000000D-01      1.0000000
            P    1   1.00
                  0.0360000              1.0000000
            D    4   1.00
                  4.6170975867          -0.13574476955D-01
                  1.5663438480           0.20374310496
                  0.66952425826          0.42997453105
                  0.27140946867          0.4179975484761
            D    1   1.00
                  0.10054426592          1.0000000
            F    1   1.00
                  0.5227000              1.0000000
            ****
            -Mo     0
            S    3   1.00
                  7.2033800000          -0.89310617237
                  5.0522950000           1.6074095756
                  2.9135330000           0.27804186088
            S    1   1.00
                  0.97858218681          1.0000000
            S    1   1.00
                  0.44369153753          1.0000000
            S    1   1.00
                  0.92150090705D-01      1.0000000
            S    1   1.00
                  0.34802246935D-01      1.0000000
            P    4   1.00
                  3.1518660000          -0.71873040872
                  2.4534820000           0.76442887870
                  0.85030192180          0.64808585640
                  0.36918237179          0.26792115234
            P    1   1.00
                  0.13490627460          1.0000000
            P    1   1.00
                  0.71800000000D-01      1.0000000
            P    1   1.00
                  0.38200000000D-01      1.0000000
            D    4   1.00
                  5.0044445497          -0.21587364862D-01
                  1.7736823324           0.20958680086
                  0.76950591696          0.43730880599
                  0.31530878939          0.41123927009
            D    1   1.00
                  0.11754374390          1.0000000
            F    1   1.00
                  0.6554500              1.0000000
            ****
            -Tc     0
            S    3   1.00
                  7.4344020000          -1.1436289973
                  5.5513270000           1.8752000559
                  3.0230860000           0.23952854431
            S    1   1.00
                  1.0647443990           1.0000000
            S    1   1.00
                  0.48127808497          1.0000000
            S    1   1.00
                  0.98299016952D-01      1.0000000
            S    1   1.00
                  0.36659977936D-01      1.0000000
            P    4   1.00
                  3.4490050000          -0.72277510434
                  2.6927370000           0.76458962802
                  0.94427370692          0.64533225171
                  0.41348148619          0.27195668811
            P    1   1.00
                  0.15488152305          1.0000000
            P    1   1.00
                  0.79000000000D-01      1.0000000
            P    1   1.00
                  0.40300000000D-01      1.0000000
            D    4   1.00
                  5.0906268699          -0.32176405405D-01
                  2.0156178510           0.21280802536
                  0.88113887240          0.44403309175
                  0.36427094833          0.40796933085
            D    1   1.00
                  0.13678402297          1.0000000
            F    1   1.00
                  0.7908500              1.0000000
            ****
            -Ru     0
            S    3   1.00
                  7.9365700000          -1.1772083350
                  5.9842450000           1.6197059592
                  4.8822200000           0.51065807556
            S    1   1.00
                  1.1031002163           1.0000000
            S    1   1.00
                  0.49818875261          1.0000000
            S    1   1.00
                  0.10678711393          1.0000000
            S    1   1.00
                  0.39191775872D-01      1.0000000
            P    4   1.00
                  3.7546090000          -0.70777873563
                  2.9165710000           0.74954391484
                  1.0322209568           0.64660609645
                  0.45249553774          0.27029086816
            P    1   1.00
                  0.16987042198          1.0000000
            P    1   1.00
                  0.85500000000D-01      1.0000000
            P    1   1.00
                  0.43000000000D-01      1.0000000
            D    4   1.00
                  5.7341846619          -0.35266111560D-01
                  2.2483686294           0.21802502222
                  0.98376978359          0.44709565013
                  0.40379445583          0.40371732508
            D    1   1.00
                  0.14978618173          1.0000000
            F    1   1.00
                  0.9431400              1.0000000
            ****
            -Rh     0
            S    3   1.00
                  7.9177440000           0.14014042010165D+01
                  6.8412070000          -0.17975072656312D+01
                  2.9598400000          -0.16225754496571
            S    1   1.00
                  1.3166643441            .87495110714057
            S    1   1.00
                  0.56907152172          1.0000000
            S    1   1.00
                  0.10059695193          1.0000000
            S    1   1.00
                  0.37071460798D-01      1.0000000
            P    4   1.00
                  4.1360790000          -0.55183328017626
                  2.9462810000           0.61370533515352
                  1.0792431924           0.64005434538256
                  0.46611217769          0.25958050755066
            P    1   1.00
                  0.17453169991          1.0000000
            P    1   1.00
                  0.84600000000D-01      1.0000000
            P    1   1.00
                  0.0410000              1.0000000
            D    4   1.00
                  6.8847131641          -0.15962387984517D-01
                  2.3837304391           0.23047555828858
                  1.0184384022           0.44075804027937
                  0.39957494644          0.39567661995894
            D    1   1.00
                  0.13951120264          1.0000000
            F    1   1.00
                  1.0949900              1.0000000
            ****
            -Pd     0
            S    3   1.00
                  8.4756400000           1.2392391076
                  7.1657170000          -1.6563109970
                  3.1821100000          -0.13178619060
            S    1   1.00
                  1.3973644196           1.0000000
            S    1   1.00
                  0.60532955868          1.0000000
            S    1   1.00
                  0.10229514209          1.0000000
            S    1   1.00
                  0.37338972881D-01      1.0000000
            P    4   1.00
                  4.2460970000          -0.82324104973
                  3.3925940000           0.87084659933
                  1.1975891264           0.63512225791
                  0.52673750585          0.27225338752
            P    1   1.00
                  0.20607094098          1.0000000
            P    1   1.00
                  0.87300000000D-01      1.0000000
            P    1   1.00
                  0.37000000000D-01      1.0000000
            D    4   1.00
                  7.3613290985          -0.17199885828D-01
                  2.6291037258           0.23313745275
                  1.1292744634           0.44536385867
                  0.44471659896          0.39293650406
            D    1   1.00
                  0.15544893836          1.0000000
            F    1   1.00
                  1.2462900              1.0000000
            ****
            -Ag     0
            S    3   1.00
                  9.0884420000          -1.9808918797
                  7.5407310000           2.7554513347
                  2.7940050000           0.22715408381
            S    1   1.00
                  1.4918135849           1.0000000
            S    1   1.00
                  0.63579159445          1.0000000
            S    1   1.00
                  0.10368414161          1.0000000
            S    1   1.00
                  0.37460004363D-01      1.0000000
            P    4   1.00
                  4.4512400000          -0.99352103771
                  3.6752630000           1.0500525237
                  1.2610620905           0.64747532537
                  0.54212477498          0.25621550723
            P    1   1.00
                  0.20221617026          1.0000000
            P    1   1.00
                  0.91300000000D-01      1.0000000
            P    1   1.00
                  0.0412000              1.0000000
            D    4   1.00
                  7.7956672292          -0.17042912377D-01
                  2.8926510238           0.23446154803
                  1.2474273203           0.44765877533
                  0.49313817671          0.39064954560
            D    1   1.00
                  0.17285032603          1.0000000
            F    1   1.00
                  1.3971100              1.0000000
            ****
            -Cd     0
            S    3   1.00
                  9.7270110000          -1.7930075316
                  7.8375230000           2.6110318971
                  5.0891940000           0.10748428949
            S    1   1.00
                  1.4981738327           1.0000000
            S    1   1.00
                  0.67281383129          1.0000000
            S    1   1.00
                  0.13297424875          1.0000000
            S    1   1.00
                  0.46915090488D-01      1.0000000
            P    4   1.00
                  4.7427160000          -1.0411923051
                  3.9366550000           1.1003682332
                  1.3569243142           0.65366639411
                  0.58791569541          0.24632369113
            P    1   1.00
                  0.21371239619          1.0000000
            P    1   1.00
                  0.10500000000          1.0000000
            P    1   1.00
                  0.0516000              1.0000000
            D    4   1.00
                  7.8631040859          -0.21376239365D-01
                  3.2935059133           0.22596399568
                  1.4503676025           0.45294402972
                  0.59373316766          0.39218971958231D+00
            D    1   1.00
                  0.21760141520          1.0000000
            F    1   1.00
                  1.5981300              1.0000000
            ****
            -In     0
            S    6   1.00
                283.52297445             0.70132141424D-03
                 23.324282101           -0.90887432418D-01
                 16.868026844            0.28096825177
                  6.7866498137          -0.70697832452
                  1.6782596016           0.98671644913
                  0.78396870439          0.62568576302
            S    2   1.00
                  1.8276654775          -0.34151640249
                  0.83753492534         -0.59696724334
            S    1   1.00
                  0.16643068973          1.0000000
            S    1   1.00
                  0.61143742809D-01      1.0000000
            S    1   1.00
                  0.25528481617D-01      1.0000000
            P    4   1.00
                 14.699191826            0.92248042349D-01
                  8.8709038051          -0.32437029300
                  1.1342905889           0.61162217018
                  0.52667652433          0.17609640386
            P    1   1.00
                  2.3284433667           1.0000000
            P    1   1.00
                  0.16859144934          1.0000000
            P    1   1.00
                  0.50070381081D-01      1.0000000
            D    5   1.00
                 31.378655926            0.54007004722D-02
                 18.290046326           -0.11208558948D-01
                  3.2551894590           0.30384519161
                  1.3874842584           0.54078109979
                  0.54248962672          0.38232680038
            D    1   1.00
                  0.18000000000          1.0000000
            D    1   1.00
                  0.41325112998D-01      1.0000000
            ****
            -Sn     0
            S    6   1.00
                375.95156177             0.15224884228D-02
                 23.661818008           -0.16776065030
                 19.946281315            0.33989090393
                  6.8240270454          -0.84441791529
                  1.8771488722           0.92646952846
                  0.82033199226          0.53091094490
            S    2   1.00
                 10.341549887           -0.90331119154D-02
                  1.3672524155           0.22980877714
            S    1   1.00
                  0.18314843823          1.0000000
            S    1   1.00
                  0.69547226146D-01      1.0000000
            S    1   1.00
                  0.34867474697D-01      1.0000000
            P    4   1.00
                 21.293597748            0.37103218279D-01
                  8.8171842499          -0.32351709661
                  1.2347028371           0.83846760898
                  0.57869142617          0.23294977050
            P    1   1.00
                  2.5084050284           1.0000000
            P    1   1.00
                  0.21298577719          1.0000000
            P    1   1.00
                  0.67364584657D-01      1.0000000
            D    5   1.00
                 39.693023177            0.39185734275D-02
                 20.852179275           -0.68210073667D-02
                  3.6907832774           0.27938420495
                  1.5849404530           0.52607409874
                  0.62772693365          0.36149465348
            D    1   1.00
                  0.20500000000          1.0000000
            D    1   1.00
                  0.54356625231D-01      1.0000000
            ****
            -Sb     0
            S    6   1.00
                372.76139166             0.15878057239D-02
                 22.689478596           -0.15027605583
                 18.391547037            0.35915813039
                  7.6406271414          -0.74805091065
                  1.9052000235           0.92017581656
                  0.93007107773          0.46754079597
            S    2   1.00
                 10.584496987           -0.14845336778D-01
                  1.4680242769           0.35289492025
            S    1   1.00
                  0.21621190032          1.0000000
            S    1   1.00
                  0.83546307041D-01      1.0000000
            S    1   1.00
                  0.43729879440D-01      1.0000000
            P    4   1.00
                 15.926550950            0.13206950012
                 10.052739237           -0.41511149340
                  1.2682183726           0.74197972626
                  0.57196620929          0.15580772750
            P    1   1.00
                  2.6190751238           1.0000000
            P    1   1.00
                  0.25183282652          1.0000000
            P    1   1.00
                  0.83389127684D-01      1.0000000
            D    5   1.00
                 45.485063360            0.32556415807D-02
                 18.504059617           -0.54952972010D-02
                  3.9156032308           0.27988806353
                  1.7142196009           0.51273377761
                  0.69675478242          0.33288802736
            D    1   1.00
                  0.23060000000          1.0000000
            D    1   1.00
                  0.66830850850D-01      1.0000000
            ****
            -Te     0
            S    6   1.00
                396.47954659             0.26307731203D-02
                 21.919773309           -0.13203517066
                 18.061271390            0.36203197834
                  8.1403463241          -0.75591120276
                  2.0705998798           0.79192928400
                  0.97715185085          0.40558342540
            S    2   1.00
                 11.263563841           -0.15212984183D-01
                  1.6122696062           0.35202140517
            S    1   1.00
                  0.25095401705          1.0000000
            S    1   1.00
                  0.97478452576D-01      1.0000000
            S    1   1.00
                  0.38352170654D-01      1.0000000
            P    4   1.00
                 17.479502221            0.11517799182
                 10.433943171           -0.41205302672
                  1.3623024763           0.78760578076
                  0.59239616258          0.15283299018
            P    1   1.00
                  2.7961737670           1.0000000
            P    1   1.00
                  0.29766401026          1.0000000
            P    1   1.00
                  0.96151090240D-01      1.0000000
            P    1   1.00
                  0.26339831052D-01      1.0000000
            D    5   1.00
                 50.821835991            0.33763474774D-02
                 18.884095378           -0.35221408938D-02
                  4.2527304630           0.28254216065
                  1.8757557092           0.52039372916
                  0.77069282849          0.32213541689
            D    1   1.00
                  0.25000000000          1.0000000
            D    1   1.00
                  0.66543837442D-01      1.0000000
            ****
            -I     0
            S    6   1.00
                445.90489176             0.20037290389D-02
                 23.336842412           -0.14989397324
                 19.583446104            0.36436474913
                  8.5112089186          -0.75538138199
                  2.1996161861           0.82816359356
                  1.0668970454           0.42161048110
            S    2   1.00
                 11.720547572           -0.16160234511D-01
                  1.7625986449           0.35271525193
            S    1   1.00
                  0.28697476318          1.0000000
            S    1   1.00
                  0.11227609607          1.0000000
            S    1   1.00
                  0.45123635492D-01      1.0000000
            P    4   1.00
                 20.499027254            0.77159335656D-01
                 10.558754576           -0.38370372780
                  1.5015895485           0.83554174719
                  0.64597173095          0.16787259488
            P    1   1.00
                  3.0288656771           1.0000000
            P    1   1.00
                  0.34506591841          1.0000000
            P    1   1.00
                  0.11134513813          1.0000000
            P    1   1.00
                  0.29795507230D-01      1.0000000
            D    5   1.00
                 51.235354920            0.40345130346D-02
                 15.616239482           -0.50768108881D-02
                  4.5266002139           0.29151065356
                  2.0529808766           0.51145783605
                  0.87640281623          0.31232025297
            D    1   1.00
                  0.30900000000          1.0000000
            D    1   1.00
                  0.77987255180D-01      1.0000000
            ****
            -Xe     0
            S    5   1.00
               6420.2481656              0.25092173886D-03
                983.54530664             0.16251948178D-02
                219.43881364             0.46037106451D-02
                 23.012587807           -0.14698707182
                 18.048324490            0.57524870348
            S    2   1.00
                 11.752550163            0.66038420156
                  6.2390917199           0.38470524721
            S    1   1.00
                  2.6257211320           1.0000000
            S    1   1.00
                  1.2905042943           1.0000000
            S    1   1.00
                  0.36204185060          1.0000000
            S    1   1.00
                  0.14069888091          1.0000000
            S    1   1.00
                  0.50201095588D-01      1.0000000
            P    4   1.00
                 13.960683826           -0.50950157807D-01
                  4.0928947097           0.36669211800
                  2.2546815460           0.72619456861
                  1.1546596184           0.35555871740
            P    3   1.00
                193.81432545             0.95394802497D-03
                 21.725228086            0.57393353332D-01
                  9.8891605641          -0.27974266640
            P    1   1.00
                  0.52321923128          1.0000000
            P    1   1.00
                  0.21945569800          1.0000000
            P    1   1.00
                  0.86158996836D-01      1.0000000
            P    1   1.00
                  0.23749464135D-01      1.0000000
            D    6   1.00
                135.60300038             0.81873543290D-03
                 38.727062692            0.60897654151D-02
                 15.377328089           -0.92782985596D-02
                  5.2602537686           0.22890785589
                  2.6590627424           0.44434407051
                  1.2938205124           0.36029482992
            D    1   1.00
                  0.58050830139          1.0000000
            D    1   1.00
                  0.18000000000          1.0000000
            D    1   1.00
                  0.68002755933D-01      1.0000000
            F    1   1.00
                  2.5000000              1.0000000
            F    1   1.00
                  0.49652793             1.0000000
            ****
            -Cs     0
            S    3   1.00
                  5.8778113443           0.12859994983
                  4.3631538286          -0.34632569725
                  1.8048475155           0.69930637051
            S    1   1.00
                  0.37485237136          1.0000000
            S    1   1.00
                  0.16384858778          1.0000000
            S    1   1.00
                  0.27230462048D-01      1.0000000
            S    1   1.00
                  0.11991533212D-01      1.0000000
            P    4   1.00
                  4.2751856154           0.45723074174D-01
                  1.9656663360          -0.25019961976
                  0.47689195212          0.55660850066
                  0.21529749588          0.58218553406
            P    1   1.00
                  0.91450850296D-01      1.0000000
            P    1   1.00
                  0.17592078473D-01      1.0000000
            P    1   1.00
                  0.33986441258D-02      1.0000000
            D    1   1.00
                  0.1330000              1.0000000
            D    1   1.00
                  0.33216214821D-01      1.0000000
            ****
            -Ba     0
            S    3   1.00
                  2.3961900000          -5.9554766710
                  2.2433050000           6.6805648241
                  0.71740200000         -0.57055347037
            S    1   1.00
                  0.27420073547          1.0000000
            S    1   1.00
                  0.40933264188D-01      1.0000000
            S    1   1.00
                  0.18060156423D-01      1.0000000
            P    4   1.00
                  2.9267420000           0.79815276764
                  2.5207180000          -1.0707548832
                  0.67578180854          0.34940781448
                  0.31985844531          0.65041110673
            P    1   1.00
                  0.13221792446          1.0000000
            P    1   1.00
                  0.33039565349D-01      1.0000000
            P    1   1.00
                  0.14159090510D-01      1.0000000
            D    4   1.00
                  0.9663150             -0.9089380
                  0.8938280              0.9472400
                  0.2731950              0.3220570
                  0.1038910              0.4732600
            D    1   1.00
                  0.0355780              0.365977
            F    4   1.00
                 10.00                   0.073
                  3.20                   0.210
                  1.00                   0.350
                  0.32                   0.360
            ****
            -La     0
            S    2   1.00
                  5.0873990000          -0.44173707857
                  4.2709780000           0.85812489720
            S    1   1.00
                  2.1823803999           1.0000000
            S    1   1.00
                  0.48954926461          1.0000000
            S    1   1.00
                  0.23292032550          1.0000000
            S    1   1.00
                  0.55595529876D-01      1.0000000
            S    1   1.00
                  0.22795184937D-01      1.0000000
            P    4   1.00
                  3.0251610000          -0.28580266654872D+00
                  2.3820950000           0.51718364643673D+00
                  0.67246658081         -0.44823115995325D+00
                  0.32519427171         -0.58864843929619D+00
            P    1   1.00
                  0.13635489374          1.0000000
            P    1   1.00
                  0.58500000000D-01      1.0000000
            P    1   1.00
                  0.0251000              1.0000000
            D    4   1.00
                  1.2667182018          -0.17445579381106D+00
                  0.89049882672          0.25137236211233D+00
                  0.32947291040          0.44604068239531D+00
                  0.13398788830          0.44878277154181D+00
            D    1   1.00
                  0.51275503081D-01      1.0000000
            F    1   1.00
                  0.2568300              1.0000000
            ****
            -Hf     0
            S    2   1.00
                 14.592485000           -0.80196298812
                 11.547491000            1.5261602829
            S    1   1.00
                  4.9112973928           1.0000000
            S    1   1.00
                  0.79665469409          1.0000000
            S    1   1.00
                  0.34234072894          1.0000000
            S    1   1.00
                  0.98109197714D-01      1.0000000
            S    1   1.00
                  0.36190984443D-01      1.0000000
            P    4   1.00
                  6.7265310000           0.65076205465872
                  5.9599790000          -0.83713508620273
                  1.0921117054           0.50570506286223
                  0.49702823217          0.51965388690539
            P    1   1.00
                  0.20258973792          1.0000000
            P    1   1.00
                  0.82500000000D-01      1.0000000
            P    1   1.00
                  0.0336000              1.0000000
            D    4   1.00
                  3.9820623229          -0.042446023944105
                  1.3077987772           0.18409232564002
                  0.53272310298          0.41484423515705
                  0.20564954488          0.44224303496859
            D    1   1.00
                  0.73099858787D-01      1.0000000
            F    1   1.00
                  0.3154700              1.0000000
            ****
            -Ta     0
            S    2   1.00
                 14.400000000            0.99343296745
                 12.000000000           -1.6510077975
            S    1   1.00
                  5.0701477302           1.0000000
            S    1   1.00
                  0.86033356487          1.0000000
            S    1   1.00
                  0.37158938894          1.0000000
            S    1   1.00
                  0.10745336254          1.0000000
            S    1   1.00
                  0.39142776556D-01      1.0000000
            P    4   1.00
                  7.4188720000           0.26979695152
                  5.6984100000          -0.46968874449
                  1.1777211960           0.50905100155
                  0.54478533555          0.52298161137
            P    1   1.00
                  0.22309270117          1.0000000
            P    1   1.00
                  0.98100000000D-01      1.0000000
            P    1   1.00
                  0.0431000              1.0000000
            D    4   1.00
                  3.9738796278          -0.52799310714D-01
                  1.4528884813           0.18558319471
                  0.61042908544          0.42959071631
                  0.24216276510          0.43497228231503D+00
            D    1   1.00
                  0.87909318337D-01      1.0000000
            F    1   1.00
                  0.3738600              1.0000000
            ****
            -W     0
            S    2   1.00
                 15.000000000           -0.53315505392
                 12.000000000            1.0014141748
            S    1   1.00
                  5.2610967725           1.0000000
            S    1   1.00
                  0.92785370307          1.0000000
            S    1   1.00
                  0.40334458241          1.0000000
            S    1   1.00
                  0.11585976646          1.0000000
            S    1   1.00
                  0.41800474073D-01      1.0000000
            P    4   1.00
                  7.2496570000           0.45857265530
                  6.0848760000          -0.66720686321
                  1.2523777812           0.52090351989
                  0.58569208922          0.51885687511
            P    1   1.00
                  0.24106964301          1.0000000
            P    1   1.00
                  0.98600000000D-01      1.0000000
            P    1   1.00
                  0.0403000              1.0000000
            D    4   1.00
                  4.0131231332          -0.63416491808D-01
                  1.6237452450           0.18452733732
                  0.69187452392          0.44121676843
                  0.27865835325          0.43158409241461D+00
            D    1   1.00
                  0.10225296446          1.0000000
            F    1   1.00
                  0.4319900              1.0000000
            ****
            -Re     0
            S    2   1.00
                 14.781862000           -1.1395193885
                 12.324075000            1.9371421121
            S    1   1.00
                  5.5098597284           1.0000000
            S    1   1.00
                  0.98874104687          1.0000000
            S    1   1.00
                  0.42833312030          1.0000000
            S    1   1.00
                  0.12296804533          1.0000000
            S    1   1.00
                  0.43949851581D-01      1.0000000
            P    4   1.00
                  7.4040050000           0.54510937865
                  6.3502060000          -0.76096056536
                  1.3311713455           0.53252276765
                  0.62659600547          0.51483045040
            P    1   1.00
                  0.25922718696          1.0000000
            P    1   1.00
                  0.11190000000          1.0000000
            P    1   1.00
                  0.04200000000          1.0000000
            D    4   1.00
                  4.0616274916          -0.76667295205D-01
                  1.8487943286           0.18067495215
                  0.78702048429          0.45160766937
                  0.32069843172          0.43261236265745D+00
            D    1   1.00
                  0.11892742980          1.0000000
            F    1   1.00
                  0.4898900              1.0000000
            ****
            -Os     0
            S    2   1.00
                 15.286736000           -1.0647114485
                 12.700638000            1.8433193269
            S    1   1.00
                  5.7094832504           1.0000000
            S    1   1.00
                  1.0689228744           1.0000000
            S    1   1.00
                  0.46783543749          1.0000000
            S    1   1.00
                  0.13253456992          1.0000000
            S    1   1.00
                  0.47101982911D-01      1.0000000
            P    4   1.00
                  7.9362790000           0.33899369659
                  6.3036410000          -0.56379438345
                  1.4351579676           0.52360040577
                  0.68442749722          0.52445339821
            P    1   1.00
                  0.28347394974          1.0000000
            P    1   1.00
                  0.12830000000          1.0000000
            P    1   1.00
                  0.04800000000          1.0000000
            D    4   1.00
                  3.5808150000          -0.42773932262
                  3.1961650000           0.44501403992
                  1.0550226354           0.43689459722
                  0.41588406618          0.48220605798770D+00
            D    1   1.00
                  0.14653507868          1.0000000
            F    1   1.00
                  0.5506500              1.0000000
            ****
            -Ir     0
            S    2   1.00
                 15.293709000           -1.6731899791
                 13.573682000            2.3934378976
            S    1   1.00
                  5.8213436542           1.0000000
            S    1   1.00
                  1.1520364268           1.0000000
            S    1   1.00
                  0.51104895338          1.0000000
            S    1   1.00
                  0.14084043578          1.0000000
            S    1   1.00
                  0.49828673085D-01      1.0000000
            P    4   1.00
                  8.6697960000           0.21469187346391
                  6.2456140000          -0.44863071815131
                  1.5657036153           0.50653393256771
                  0.75577412863          0.54052273352337
            P    1   1.00
                  0.31306011113          1.0000000
            P    1   1.00
                  0.13100000000          1.0000000
            P    1   1.00
                  0.0548000              1.0000000
            D    4   1.00
                  3.6994850000          -0.54840155964653
                  3.3617430000           0.56835425804006
                  1.1177053710           0.44304381513032
                  0.44322534858          0.47078394930144
            D    1   1.00
                  0.15641305125          1.0000000
            F    1   1.00
                  0.6100800              1.0000000
            ****
            -Pt     0
            S    2   1.00
                 16.559563000           -0.53808800717
                 13.892440000            0.91402161377
            S    1   1.00
                  5.8531044732           1.0000000
            S    1   1.00
                  1.2498640609           1.0000000
            S    1   1.00
                  0.55606439459          1.0000000
            S    1   1.00
                  0.13793093812          1.0000000
            S    1   1.00
                  0.48989034059D-01      1.0000000
            P    4   1.00
                  8.1000000000           0.72955608128
                  7.2000000000          -0.95441807252
                  1.5588402917           0.57140490320
                  0.73230402180          0.49508234268
            P    1   1.00
                  0.30270484669          1.0000000
            P    1   1.00
                  0.12300000000          1.0000000
            P    1   1.00
                  0.50000000000D-01      1.0000000
            D    4   1.00
                  4.6299536825          -0.87774450596D-01
                  2.1980241252           0.21158360681
                  0.93629991261          0.46533857641
                  0.37160028160          0.41129165525
            D    1   1.00
                  0.13155928617          1.0000000
            F    1   1.00
                  0.6681300              1.0000000
            ****
            -Au     0
            S    2   1.00
                 20.115299000           -0.15910719389
                 12.193477000            0.79105526778
            S    1   1.00
                  6.0735294368           1.0000000
            S    1   1.00
                  1.3174451569           1.0000000
            S    1   1.00
                  0.58596768244          1.0000000
            S    1   1.00
                  0.13875427354          1.0000000
            S    1   1.00
                  0.48876985527D-01      1.0000000
            P    4   1.00
                  8.6096650000           0.50053018599
                  7.3353260000          -0.72681584494
                  1.6575296365           0.57315511417
                  0.78159310216          0.49579068859
            P    1   1.00
                  0.32384840661          1.0000000
            P    1   1.00
                  0.13220000000          1.0000000
            P    1   1.00
                  0.0540000              1.0000000
            D    4   1.00
                  4.1439490000          -0.37099566643
                  3.5682570000           0.40197233762
                  1.2345757130           0.46001988624
                  0.48190232338          0.46152130957882D+00
            D    1   1.00
                  0.16490636769          1.0000000
            F    1   1.00
                  0.7248200              1.0000000
            ****
            -Hg     0
            S    2   1.00
                 26.842049000           -0.26845096483D-01
                 10.320909000            0.81771278143
            S    1   1.00
                  6.3656242291           1.0000000
            S    1   1.00
                  1.3898932095           1.0000000
            S    1   1.00
                  0.63706742699          1.0000000
            S    1   1.00
                  0.16047725098          1.0000000
            S    1   1.00
                  0.56410423453D-01      1.0000000
            P    4   1.00
                  9.7729900000           0.21210940502
                  7.1690950000          -0.44026342153
                  1.7559567931           0.58406314464
                  0.83145670425          0.49359746203
            P    1   1.00
                  0.34494917659          1.0000000
            P    1   1.00
                  0.15540000000          1.0000000
            P    1   1.00
                  0.07000000000          1.0000000
            D    4   1.00
                  4.2800000000          -0.32033414305491
                  3.4800000000           0.37748470203231
                  1.2535869926           0.48342275878173
                  0.50841366863          0.43493523158359
            D    1   1.00
                  0.18501599388          1.0000000
            F    1   1.00
                  0.7956900              1.0000000
            ****
            -Tl     0
            S    6   1.00
                 45.356924655            0.50938157397D-02
                 20.278843336           -0.14805704314
                 14.420612394            0.36768453564
                  6.2161909754          -0.66820394623
                  1.5002511178           0.96232806743
                  0.76330879305          0.33175999361
            S    2   1.00
                  7.8193195283          -0.18828631537D-01
                  1.3176904042           0.32093431467
            S    1   1.00
                  0.17643545481          1.0000000
            S    1   1.00
                  0.65296835238D-01      1.0000000
            S    1   1.00
                  0.24592841139D-01      1.0000000
            P    4   1.00
                  9.0323058024           0.22738839085
                  7.5356419671          -0.35117975889
                  1.0521421998           0.25690085604
                  0.50303932656          0.84549942764D-01
            P    1   1.00
                  2.0067660913           1.0000000
            P    1   1.00
                  0.16675605056          1.0000000
            P    1   1.00
                  0.48596401464D-01      1.0000000
            D    5   1.00
                  9.4421940760           0.58250776986D-01
                  7.4410003381          -0.11789199301
                  1.9831617772           0.34232057636
                  0.91671748567          0.47557282350
                  0.39647207885          0.30528029435
            D    1   1.00
                  0.15500000000          1.0000000
            D    1   1.00
                  0.39237960293D-01      1.0000000
            ****
            -Pb     0
            S    6   1.00
                 55.727520333            0.29681153058D-02
                 20.302912827           -0.14352634362
                 14.558628750            0.37554188507
                  6.5370530973          -0.67253099800
                  1.5933900686           0.95887533909
                  0.83051419711          0.32593632538
            S    2   1.00
                  8.0719473648          -0.20412061217D-01
                  1.4165737490           0.32865829049
            S    1   1.00
                  0.20418933370          1.0000000
            S    1   1.00
                  0.77159007761D-01      1.0000000
            S    1   1.00
                  0.33059793391D-01      1.0000000
            P    4   1.00
                  9.5531412199           0.20542943990
                  7.5327685129          -0.36407590058
                  1.1185539567           0.32217481686
                  0.53739855255          0.96677743015D-01
            P    1   1.00
                  2.1359869828           1.0000000
            P    1   1.00
                  0.20027494801          1.0000000
            P    1   1.00
                  0.63408011513D-01      1.0000000
            D    5   1.00
                 13.494505735            0.11571042371D-01
                  7.0609770411          -0.66746645076D-01
                  2.1581835375           0.33978760942
                  1.0148541418           0.48523039273
                  0.44632672920          0.29682924018
            D    1   1.00
                  0.17500000000          1.0000000
            D    1   1.00
                  0.50585085346D-01      1.0000000
            ****
            -Bi     0
            S    6   1.00
                175.19632102             0.80278879028D-03
                 19.820147783           -0.14624461250
                 14.960110102            0.37435719885
                  6.7065785571          -0.68476017748
                  1.7391967524           0.90967322081
                  0.94504730591          0.38695797807
            S    2   1.00
                  8.4636832909          -0.20037183144D-01
                  1.5317838545           0.31054408682
            S    1   1.00
                  0.23405391503          1.0000000
            S    1   1.00
                  0.90268814613D-01      1.0000000
            S    1   1.00
                  0.41577775054D-01      1.0000000
            P    4   1.00
                 10.672046293            0.14391258793
                  7.1992185915          -0.37994608603
                  1.5359697528           0.53268032065
                  0.72201275727          0.23037698678
            P    1   1.00
                  2.8508661858           1.0000000
            P    1   1.00
                  0.23769418731          1.0000000
            P    1   1.00
                  0.78768140453D-01      1.0000000
            D    5   1.00
                 15.834273510            0.85062993231D-02
                  7.0956896087          -0.65954380016D-01
                  2.3363137007           0.33707163406
                  1.1208861366           0.49128719933
                  0.50309487376          0.29095930644
            D    1   1.00
                  0.20000000000          1.0000000
            D    1   1.00
                  0.62256480090D-01      1.0000000
            ****
            -Po     0
            S    6   1.00
                278.13783916             0.91690497839D-03
                 19.659291105           -0.14713009283
                 15.016229647            0.38790413631
                  7.1149978720          -0.67059966298
                  1.7879214122           0.91212928327
                  0.94021655206          0.29153755200
            S    2   1.00
                  8.7584161749          -0.21561417525D-01
                  1.6503945866           0.31638990001
            S    1   1.00
                  0.26329582133          1.0000000
            S    1   1.00
                  0.10190654304          1.0000000
            S    1   1.00
                  0.36854928339D-01      1.0000000
            P    4   1.00
                 10.445945973            0.23631841405
                  8.0293101888          -0.45017818996
                  1.3588798023           0.44160334658
                  0.66829182929          0.14575285544
            P    1   1.00
                  2.4460635387           1.0000000
            P    1   1.00
                  0.27242942777          1.0000000
            P    1   1.00
                  0.88796031338D-01      1.0000000
            P    1   1.00
                  0.24278917089D-01      1.0000000
            D    5   1.00
                 18.292670150            0.72030963652D-02
                  7.1695578539          -0.66160544754D-01
                  2.5029225180           0.34363449378
                  1.2115945443           0.50529101033
                  0.54713334240          0.28301155453
            D    1   1.00
                  0.21500000000          1.0000000
            D    1   1.00
                  0.60680939679D-01      1.0000000
            ****
            -At     0
            S    6   1.00
                303.23376176             0.63504969788D-03
                 20.289449240           -0.13823165350
                 15.383783126            0.38333193283
                  7.4702184232          -0.66837560338
                  1.8731608346           0.91545877992
                  0.97426847543          0.25559567998
            S    2   1.00
                  8.9610112498          -0.23092977605D-01
                  1.7804284294           0.31690635939
            S    1   1.00
                  0.29269461143          1.0000000
            S    1   1.00
                  0.11395353119          1.0000000
            S    1   1.00
                  0.42558321816D-01      1.0000000
            P    4   1.00
                 10.722023134            0.26194870008
                  8.4823338656          -0.46607228264
                  1.3474291294           0.42119853309
                  0.62824011467          0.10643224457
            P    1   1.00
                  2.4814896839           1.0000000
            P    1   1.00
                  0.31036518470          1.0000000
            P    1   1.00
                  0.10144862043          1.0000000
            P    1   1.00
                  0.26996558228D-01      1.0000000
            D    5   1.00
                 20.799819604            0.65227965381D-02
                  7.1664616770          -0.67780885217D-01
                  2.6934397048           0.33954991335
                  1.3175112423           0.50899559178
                  0.59997066293          0.27526771759
            D    1   1.00
                  0.23500000000          1.0000000
            D    1   1.00
                  0.67929272623D-01      1.0000000
            ****
            -Rn     0
            S    5   1.00
               5187.7442468              0.16097034848D-03
                768.14491207             0.10508214789D-02
                159.35182065             0.27375438093D-02
                 21.863432724           -0.55045904905
                 18.388689978            0.78321373922
            S    2   1.00
                 24.816226448           -0.82636797204D-01
                  7.2923301677           1.0926256000
            S    1   1.00
                  2.0850437166           1.0000000
            S    1   1.00
                  1.0915245945           1.0000000
            S    1   1.00
                  0.34915708428          1.0000000
            S    1   1.00
                  0.13648422952          1.0000000
            S    1   1.00
                  0.46837581728D-01      1.0000000
            P    4   1.00
                  9.0845000304          -0.23093917426
                  6.2631489717           0.39747614192
                  2.2545193734           0.83026693838
                  1.1180666918           0.51467013112
            P    3   1.00
                194.68918723             0.26265814046D-03
                 11.210013525            0.19952302621
                  7.5298316489          -0.45994479561
            P    1   1.00
                  0.47444492594          1.0000000
            P    1   1.00
                  0.20172354616          1.0000000
            P    1   1.00
                  0.79503144392D-01      1.0000000
            P    1   1.00
                  0.22264519316D-01      1.0000000
            D    6   1.00
                 75.302723665            0.73590238429D-03
                 17.965913830            0.89490827389D-02
                  7.3741298033          -0.76641663693D-01
                  3.2296258578           0.22975404602
                  1.7937840508           0.43991495311
                  0.94633319732          0.35259395198
            D    1   1.00
                  0.46860482223          1.0000000
            D    1   1.00
                  0.20000000000          1.0000000
            D    1   1.00
                  0.68815941916D-01      1.0000000
            F    1   1.00
                  2.1000000              1.0000000
            F    1   1.00
                  0.4180600              1.0000000
            ****
            
            -RB     0
            RB-ECP     3     28
            f potential
              1
            2      3.8431140            -12.3169000
            s-f potential
              3
            2      5.0365510             89.5001980
            2      1.9708490              0.4937610
            2      3.8431140             12.3169000
            p-f potential
              3
            2      4.2583410             58.5689740
            2      1.4707090              0.4317910
            2      3.8431140             12.3169000
            d-f potential
              3
            2      3.0231270             26.2248980
            2      0.6503830              0.9628390
            2      3.8431140             12.3169000
            -SR     0
            SR-ECP     3     28
            f potential
              1
            2      4.6339750            -15.8059920
            s-f potential
              3
            2      7.4000740            135.4794300
            2      3.6063790             17.5344630
            2      4.6339750             15.8059920
            p-f potential
              3
            2      6.4848680             88.3597090
            2      3.2880530             15.3943720
            2      4.6339750             15.8059920
            d-f potential
              3
            2      4.6228410             29.8889870
            2      2.2469040              6.6594140
            2      4.6339750             15.8059920
            -Y     0
            Y-ECP     3     28
            f potential
              2
            2      6.5842120            -19.12219811
            2      3.2921060             -2.43637543
            s-f potential
              4
            2      7.4880494            135.15384412
            2      3.7440247             15.55244130
            2      6.5842120             19.12219811
            2      3.2921060              2.43637543
            p-f potential
              4
            2      6.4453772             87.78499167
            2      3.2226886             11.56406599
            2      6.5842120             19.12219811
            2      3.2921060              2.43637543
            d-f potential
              4
            2      4.6584472             29.70100072
            2      2.3292236              5.53996847
            2      6.5842120             19.12219811
            2      3.2921060              2.43637543
            -ZR     0
            ZR-ECP     3     28
            f potential
              2
            2      7.5400000            -21.09377605
            2      3.7700000             -3.08069427
            s-f potential
              4
            2      8.2000000            150.26759106
            2      4.0897278             18.97621650
            2      7.5400000             21.09377605
            2      3.7700000              3.08069427
            p-f potential
              4
            2      7.1100000             99.62212372
            2      3.5967980             14.16873329
            2      7.5400000             21.09377605
            2      3.7700000              3.08069427
            d-f potential
              4
            2      5.3500000             35.04512355
            2      2.4918215              6.11125948
            2      7.5400000             21.09377605
            2      3.7700000              3.08069427
            -NB     0
            NB-ECP     3     28
            f potential
              2
            2      8.4900000            -22.92954996
            2      4.2500000             -3.66630986
            s-f potential
              4
            2      8.9000000            165.17914349
            2      4.4300000             21.99297437
            2      8.4900000             22.92954996
            2      4.2500000              3.66630986
            p-f potential
              4
            2      7.7700000            111.79441445
            2      3.9600000             16.63348326
            2      8.4900000             22.92954996
            2      4.2500000              3.66630986
            d-f potential
              4
            2      6.0500000             38.11224880
            2      2.8400000              8.03916727
            2      8.4900000             22.92954996
            2      4.2500000              3.66630986
            -MO     0
            MO-ECP     3     28
            f potential
              2
            2      9.4500000            -24.80517707
            2      4.7200000             -4.15378155
            s-f potential
              4
            2      9.7145938            180.10310850
            2      4.6805004             24.99722791
            2      9.4500000             24.80517707
            2      4.7200000              4.15378155
            p-f potential
              4
            2      8.1421366            123.77275231
            2      4.6259863             19.53022800
            2      9.4500000             24.80517707
            2      4.7200000              4.15378155
            d-f potential
              4
            2      6.6184148             48.37502229
            2      3.2487516              8.89205274
            2      9.4500000             24.80517707
            2      4.7200000              4.15378155
            -TC     0
            TC-ECP     3     28
            f potential
              2
            2     10.4000000            -26.56244747
            2      5.2000000             -4.58568054
            s-f potential
              4
            2     10.4223462            195.15916591
            2      5.0365160             28.09260333
            2     10.4000000             26.56244747
            2      5.2000000              4.58568054
            p-f potential
              4
            2      8.9504494            135.28456622
            2      4.8544394             21.80650430
            2     10.4000000             26.56244747
            2      5.2000000              4.58568054
            d-f potential
              4
            2      6.9456968             54.32972942
            2      3.9705849             11.15506795
            2     10.4000000             26.56244747
            2      5.2000000              4.58568054
            -RU     0
            RU-ECP     3     28
            f potential
              2
            2     11.3600000            -28.34061627
            2      5.6800000             -4.94462923
            s-f potential
              4
            2     11.1052693            209.82297122
            2      5.4147454             30.65472642
            2     11.3600000             28.34061627
            2      5.6800000              4.94462923
            p-f potential
              4
            2      9.7712707            146.33618228
            2      5.0739908             24.12787723
            2     11.3600000             28.34061627
            2      5.6800000              4.94462923
            d-f potential
              4
            2      7.6714231             67.51589667
            2      4.1365647              9.87010415
            2     11.3600000             28.34061627
            2      5.6800000              4.94462923
            -RH     0
            RH-ECP     3     28
            f potential
              2
            2     12.3100000            -30.09345572
            2      6.1600000             -5.21848192
            s-f potential
              4
            2     11.7200000            225.34775353
            2      5.8200000             32.82318898
            2     12.3100000             30.09345572
            2      6.1600000              5.21848192
            p-f potential
              4
            2     10.4200000            158.70941159
            2      5.4500000             26.44410049
            2     12.3100000             30.09345572
            2      6.1600000              5.21848192
            d-f potential
              4
            2      8.8200000             62.75862572
            2      3.8700000             10.97871947
            2     12.3100000             30.09345572
            2      6.1600000              5.21848192
            -PD     0
            PD-ECP     3     28
            f potential
              2
            2     13.2700000            -31.92955431
            2      6.6300000             -5.39821694
            s-f potential
              4
            2     12.4300000            240.22904033
            2      6.1707594             35.17194347
            2     13.2700000             31.92955431
            2      6.6300000              5.39821694
            p-f potential
              4
            2     11.0800000            170.41727605
            2      5.8295541             28.47213287
            2     13.2700000             31.92955431
            2      6.6300000              5.39821694
            d-f potential
              4
            2      9.5100000             69.01384488
            2      4.1397811             11.75086158
            2     13.2700000             31.92955431
            2      6.6300000              5.39821694
            -AG     0
            AG-ECP     3     28
            f potential
              2
            2     14.2200000            -33.68992012
            2      7.1100000             -5.53112021
            s-f potential
              4
            2     13.1300000            255.13936452
            2      6.5100000             36.86612154
            2     14.2200000             33.68992012
            2      7.1100000              5.53112021
            p-f potential
              4
            2     11.7400000            182.18186871
            2      6.2000000             30.35775148
            2     14.2200000             33.68992012
            2      7.1100000              5.53112021
            d-f potential
              4
            2     10.2100000             73.71926087
            2      4.3800000             12.50211712
            2     14.2200000             33.68992012
            2      7.1100000              5.53112021
            -CD     0
            CD-ECP     3     28
            f potential
              2
            2     15.1847957            -35.47662555
            2      7.5923978             -5.61767685
            s-f potential
              4
            2     13.8358689            270.00948324
            2      6.8572704             38.76730798
            2     15.1847957             35.47662555
            2      7.5923978              5.61767685
            p-f potential
              4
            2     12.4049710            193.82962939
            2      6.5677995             31.89652523
            2     15.1847957             35.47662555
            2      7.5923978              5.61767685
            d-f potential
              4
            2     10.8969253             79.19364700
            2      4.6411649             13.23082674
            2     15.1847957             35.47662555
            2      7.5923978              5.61767685
            -IN     0
            IN-ECP     3     28
            f potential
              2
            2     12.53905600           -13.72807800
            2     12.55256100           -18.20686600
            s-f potential
              4
            2     15.39282200           281.12235000
            2      8.05586400            61.90147000
            2     12.53905600            13.72807800
            2     12.55256100            18.20686600
            p-f potential
              6
            2     13.92867200            67.46215400
            2     13.34723400           134.94925000
            2      7.61413200            14.74614000
            2      7.31836500            29.63926200
            2     12.53905600            13.72807800
            2     12.55256100            18.20686600
            d-f potential
              6
            2     14.03471500            35.49325400
            2     14.51161600            53.17877300
            2      5.55055000             9.17728100
            2      5.05941500            12.39241000
            2     12.53905600            13.72807800
            2     12.55256100            18.20686600
            -SN     0
            SN-ECP     3     28
            f potential
              2
            2     12.28234800           -12.57633300
            2     12.27215000           -16.59594400
            s-f potential
              4
            2     17.42041400           279.98868200
            2      7.63115500            62.37781000
            2     12.28234800            12.57633300
            2     12.27215000            16.59594400
            p-f potential
              6
            2     16.13102400            66.16252300
            2     15.62807700           132.17439600
            2      7.32560800            16.33941700
            2      6.94251900            32.48895900
            2     12.28234800            12.57633300
            2     12.27215000            16.59594400
            d-f potential
              6
            2     15.51497600            36.38744100
            2     15.18816000            54.50784100
            2      5.45602400             8.69682300
            2      5.36310500            12.84020800
            2     12.28234800            12.57633300
            2     12.27215000            16.59594400
            -SB     0
            SB-ECP     3     28
            f potential
              2
            2     14.44497800           -15.36680100
            2     14.44929500           -20.29613800
            s-f potential
              4
            2     16.33086500           281.07158100
            2      8.55654200            61.71660400
            2     14.44497800            15.36680100
            2     14.44929500            20.29613800
            p-f potential
              6
            2     14.47033700            67.45738000
            2     13.81619400           134.93350300
            2      8.42492400            14.71634400
            2      8.09272800            29.51851200
            2     14.44497800            15.36680100
            2     14.44929500            20.29613800
            d-f potential
              6
            2     14.88633100            35.44781500
            2     15.14631900            53.14346600
            2      5.90826700             9.17922300
            2      5.59432200            13.24025300
            2     14.44497800            15.36680100
            2     14.44929500            20.29613800
            -TE     0
            TE-ECP     3     28
            f potential
              2
            2     15.20616800           -15.74545000
            2     15.20170200           -20.74244800
            s-f potential
              4
            2     16.81447300           281.04584300
            2      8.79352600            61.62065600
            2     15.20616800            15.74545000
            2     15.20170200            20.74244800
            p-f potential
              6
            2     14.87780100            67.44946400
            2     14.26973100           134.90430400
            2      8.72443500            14.68954700
            2      8.29151500            29.41506300
            2     15.20616800            15.74545000
            2     15.20170200            20.74244800
            d-f potential
              6
            2     15.20500800            35.43205700
            2     15.22584800            53.13568700
            2      6.07176900             9.06980200
            2      5.80476000            13.12230400
            2     15.20616800            15.74545000
            2     15.20170200            20.74244800
            -I     0
            I-ECP     3     28
            f potential
              4
            2     19.45860900           -21.84204000
            2     19.34926000           -28.46819100
            2      4.82376700            -0.24371300
            2      4.88431500            -0.32080400
            s-f potential
              7
            2     40.01583500            49.99429300
            2     17.42974700           281.02531700
            2      9.00548400            61.57332600
            2     19.45860900            21.84204000
            2     19.34926000            28.46819100
            2      4.82376700             0.24371300
            2      4.88431500             0.32080400
            p-f potential
              8
            2     15.35546600            67.44284100
            2     14.97183300           134.88113700
            2      8.96016400            14.67505100
            2      8.25909600            29.37566600
            2     19.45860900            21.84204000
            2     19.34926000            28.46819100
            2      4.82376700             0.24371300
            2      4.88431500             0.32080400
            d-f potential
              10
            2     15.06890800            35.43952900
            2     14.55532200            53.17605700
            2      6.71864700             9.06719500
            2      6.45639300            13.20693700
            2      1.19177900             0.08933500
            2      1.29115700             0.05238000
            2     19.45860900            21.84204000
            2     19.34926000            28.46819100
            2      4.82376700             0.24371300
            2      4.88431500             0.32080400
            -XE     0
            XE-ECP     3     28
            f potential
              4
            2     20.88155700           -23.08929500
            2     20.78344300           -30.07447500
            2      5.25338900            -0.28822700
            2      5.36118800            -0.38692400
            s-f potential
              7
            2     40.00518400            49.99796200
            2     17.81221400           281.01330300
            2      9.30415000            61.53825500
            2     20.88155700            23.08929500
            2     20.78344300            30.07447500
            2      5.25338900             0.28822700
            2      5.36118800             0.38692400
            p-f potential
              8
            2     15.70177200            67.43914200
            2     15.25860800           134.87471100
            2      9.29218400            14.66330000
            2      8.55900300            29.35473000
            2     20.88155700            23.08929500
            2     20.78344300            30.07447500
            2      5.25338900             0.28822700
            2      5.36118800             0.38692400
            d-f potential
              10
            2     15.18560000            35.43690800
            2     14.28450000            53.19577200
            2      7.12188900             9.04623200
            2      6.99196300            13.22368100
            2      0.62394600             0.08485300
            2      0.64728400             0.04415500
            2     20.88155700            23.08929500
            2     20.78344300            30.07447500
            2      5.25338900             0.28822700
            2      5.36118800             0.38692400
            -CS     0
            CS-ECP     3     46
            f potential
              1
            2      3.1232690            -28.8843090
            s-f potential
              3
            2      4.0797500             84.5477300
            2      2.4174060             16.6541730
            2      3.1232690             28.8843090
            p-f potential
              3
            2      5.5140800            157.0490590
            2      2.1603160             26.4233070
            2      3.1232690             28.8843090
            d-f potential
              3
            2      1.8074100             13.1727530
            2      0.8581820              3.3428330
            2      3.1232690             28.8843090
            -BA     0
            BA-ECP     3     46
            f potential
              1
            2      3.5894650            -33.4731740
            s-f potential
              3
            2      9.5269860            427.8458160
            2      4.4875100            204.4175300
            2      3.5894650             33.4731740
            p-f potential
              3
            2      8.3159300            293.6058640
            2      4.2922170            294.1933160
            2      3.5894650             33.4731740
            d-f potential
              3
            2      5.9161080            112.5504020
            2      2.8748420            181.7826210
            2      3.5894650             33.4731740
            -LA     0
            LA-ECP     3     46
            f potential
              1
            2      4.0286000            -36.0100160
            s-f potential
              3
            2      3.3099000             91.9321770
            2      1.6550000             -3.7887640
            2      4.0286000             36.0100160
            p-f potential
              3
            2      2.8368000             63.7594860
            2      1.4184000             -0.6479580
            2      4.0286000             36.0100160
            d-f potential
              3
            2      2.0213000             36.1161730
            2      1.0107000              0.2191140
            2      4.0286000             36.0100160
            -HF     0
            HF-ECP     3     60
            f potential
              1
            2      1.78576984            10.04672251
            s-f potential
              3
            2     14.76995900          1499.28471073
            2      7.38497940            40.28210136
            2      1.78576984           -10.04672251
            p-f potential
              3
            2      9.84948950           397.73300533
            2      4.92474450            19.31640586
            2      1.78576984           -10.04672251
            d-f potential
              3
            2      6.09675640           101.32980526
            2      3.04837820             5.87343821
            2      1.78576984           -10.04672251
            -TA     0
            TA-ECP     3     60
            f potential
              1
            2      2.01788111            12.01796094
            s-f potential
              3
            2     14.54640770          1345.88064703
            2      7.27320380            36.76680620
            2      2.01788111           -12.01796094
            p-f potential
              3
            2      9.93556529           378.42530145
            2      4.96778243            22.29309086
            2      2.01788111           -12.01796094
            d-f potential
              3
            2      6.34737691           104.88395571
            2      3.17368846             8.75584805
            2      2.01788111           -12.01796094
            -W     0
            W-ECP     3     60
            f potential
              1
            2      2.25888846            14.15257947
            s-f potential
              3
            2     14.32285640          1192.39588226
            2      7.16142810            32.52293315
            2      2.25888846           -14.15257947
            p-f potential
              3
            2     10.02164110           359.03196711
            2      5.01082040            24.03038019
            2      2.25888846           -14.15257947
            d-f potential
              3
            2      6.59799743           108.30134897
            2      3.29899871            10.98252827
            2      2.25888846           -14.15257947
            -RE     0
            RE-ECP     3     60
            f potential
              1
            2      2.50865059            16.44985227
            s-f potential
              3
            2     14.09930510          1038.95157226
            2      7.04965250            29.56173830
            2      2.50865059           -16.44985227
            p-f potential
              3
            2     10.10771690           339.54350965
            2      5.05385830            24.91369646
            2      2.50865059           -16.44985227
            d-f potential
              3
            2      6.84861794           111.69965275
            2      3.42430897            12.62432927
            2      2.50865059           -16.44985227
            -OS     0
            OS-ECP     3     60
            f potential
              1
            2      2.76707510            18.90945701
            s-f potential
              3
            2     13.87575390           885.40571914
            2      6.93787690            25.96704014
            2      2.76707510           -18.90945701
            p-f potential
              3
            2     10.19379260           320.08390185
            2      5.09689620            26.14876493
            2      2.76707510           -18.90945701
            d-f potential
              3
            2      7.09923846           115.04484313
            2      3.54961923            13.62257457
            2      2.76707510           -18.90945701
            -IR     0
            IR-ECP     3     60
            f potential
              1
            2      3.03407192            21.53103107
            s-f potential
              3
            2     13.65220260           732.26919978
            2      6.82610130            26.48472087
            2      3.03407192           -21.53103107
            p-f potential
              3
            2     10.27986840           299.48947357
            2      5.13993410            26.46623354
            2      3.03407192           -21.53103107
            d-f potential
              3
            2      7.34985897           124.45759451
            2      3.67492949            14.03599518
            2      3.03407192           -21.53103107
            -PT     0
            PT-ECP     3     60
            f potential
              1
            2      3.30956857            24.31437573
            s-f potential
              3
            2     13.42865130           579.22386092
            2      6.71432560            29.66949062
            2      3.30956857           -24.31437573
            p-f potential
              3
            2     10.36594420           280.86077422
            2      5.18297210            26.74538204
            2      3.30956857           -24.31437573
            d-f potential
              3
            2      7.60047949           120.39644429
            2      3.80023974            15.81092058
            2      3.30956857           -24.31437573
            -AU     0
            AU-ECP     3     60
            f potential
              2
            2      4.78982000            30.49008890
            2      2.39491000             5.17107381
            s-f potential
              4
            2     13.20510000           426.84667920
            2      6.60255000            37.00708285
            2      4.78982000           -30.49008890
            2      2.39491000            -5.17107381
            p-f potential
              4
            2     10.45202000           261.19958038
            2      5.22601000            26.96249604
            2      4.78982000           -30.49008890
            2      2.39491000            -5.17107381
            d-f potential
              4
            2      7.85110000           124.79066561
            2      3.92555000            16.30072573
            2      4.78982000           -30.49008890
            2      2.39491000            -5.17107381
            -HG     0
            HG-ECP     3     60
            f potential
              1
            2      3.88579112            30.36499643
            s-f potential
              3
            2     12.98154870           275.73721174
            2      6.49077440            49.08921249
            2      3.88579112           -30.36499643
            p-f potential
              3
            2     10.53809580           241.54007398
            2      5.26904790            27.39659081
            2      3.88579112           -30.36499643
            d-f potential
              3
            2      8.10172051           127.86700761
            2      4.05086026            16.60831151
            2      3.88579112           -30.36499643
            -TL     0
            TL-ECP     3     60
            f potential
              4
            2      5.62639900            15.82548800
            2      5.54895200            21.10402100
            2      2.87494600             2.91512700
            2      2.82145100             3.89690300
            s-f potential
              6
            2     12.16780500           281.28466300
            2      8.29490900            62.43425100
            2      5.62639900           -15.82548800
            2      5.54895200           -21.10402100
            2      2.87494600            -2.91512700
            2      2.82145100            -3.89690300
            p-f potential
              8
            2      7.15149200             4.63340800
            2      5.17286500             9.34175600
            2      9.89107200            72.29925300
            2      9.00339100           144.55803700
            2      5.62639900           -15.82548800
            2      5.54895200           -21.10402100
            2      2.87494600            -2.91512700
            2      2.82145100            -3.89690300
            d-f potential
              8
            2      7.13021800            35.94303900
            2      6.92690600            53.90959300
            2      5.41757000            10.38193900
            2      5.13868100            15.58382200
            2      5.62639900           -15.82548800
            2      5.54895200           -21.10402100
            2      2.87494600            -2.91512700
            2      2.82145100            -3.89690300
            -PB     0
            PB-ECP     3     60
            f potential
              2
            2      3.88751200            12.20989200
            2      3.81196300            16.19029100
            s-f potential
              4
            2     12.29630300           281.28549900
            2      8.63263400            62.52021700
            2      3.88751200           -12.20989200
            2      3.81196300           -16.19029100
            p-f potential
              6
            2     10.24179000            72.27689700
            2      8.92417600           144.59108300
            2      6.58134200             4.75869300
            2      6.25540300             9.94062100
            2      3.88751200           -12.20989200
            2      3.81196300           -16.19029100
            d-f potential
              6
            2      7.75433600            35.84850700
            2      7.72028100            53.72434200
            2      4.97026400            10.11525600
            2      4.56378900            14.83373100
            2      3.88751200           -12.20989200
            2      3.81196300           -16.19029100
            -BI     0
            BI-ECP     3     60
            f potential
              2
            2      4.21454600            13.71338300
            2      4.13340000            18.19430800
            s-f potential
              4
            2     13.04309000           283.26422700
            2      8.22168200            62.47195900
            2      4.21454600           -13.71338300
            2      4.13340000           -18.19430800
            p-f potential
              6
            2     10.46777700            72.00149900
            2      9.11890100           144.00227700
            2      6.75479100             5.00794500
            2      6.25259200             9.99155000
            2      4.21454600           -13.71338300
            2      4.13340000           -18.19430800
            d-f potential
              6
            2      8.08147400            36.39625900
            2      7.89059500            54.59766400
            2      4.95555600             9.98429400
            2      4.70455900            14.98148500
            2      4.21454600           -13.71338300
            2      4.13340000           -18.19430800
            -PO     0
            PO-ECP     3     60
            f potential
              4
            2      5.01327000            17.42829500
            2      4.98464000            23.38035300
            2      1.32676000             0.16339200
            2      1.52875800             0.32456600
            s-f potential
              6
            2     13.27722700           283.24470600
            2      8.39951800            62.39646100
            2      5.01327000           -17.42829500
            2      4.98464000           -23.38035300
            2      1.32676000            -0.16339200
            2      1.52875800            -0.32456600
            p-f potential
              8
            2     10.66568200            71.99171600
            2      9.28375300           143.97187100
            2      6.87274900             4.94961500
            2      6.32615000             9.74049900
            2      5.01327000           -17.42829500
            2      4.98464000           -23.38035300
            2      1.32676000            -0.16339200
            2      1.52875800            -0.32456600
            d-f potential
              8
            2      8.21486600            36.37838300
            2      8.00869600            54.56271500
            2      5.05522700             9.88949900
            2      4.78255300            14.69387700
            2      5.01327000           -17.42829500
            2      4.98464000           -23.38035300
            2      1.32676000            -0.16339200
            2      1.52875800            -0.32456600
            -AT     0
            AT-ECP     3     60
            f potential
              4
            2      5.81216300            19.87019800
            2      5.75371500            26.41645200
            2      2.51347200             0.99497000
            2      2.53626100             1.49070100
            s-f potential
              7
            2     30.20083200            49.95715800
            2     13.61230600           283.21037100
            2      8.52934000            62.28105200
            2      5.81216300           -19.87019800
            2      5.75371500           -26.41645200
            2      2.51347200            -0.99497000
            2      2.53626100            -1.49070100
            p-f potential
              8
            2     10.85406500            71.98237100
            2      9.46822900           143.90353200
            2      7.03111400             4.87175900
            2      6.14385800             8.98305900
            2      5.81216300           -19.87019800
            2      5.75371500           -26.41645200
            2      2.51347200            -0.99497000
            2      2.53626100            -1.49070100
            d-f potential
              8
            2      8.31351500            36.36323700
            2      7.99896500            54.54897000
            2      5.17996600             9.77628500
            2      4.94222600            14.26475500
            2      5.81216300           -19.87019800
            2      5.75371500           -26.41645200
            2      2.51347200            -0.99497000
            2      2.53626100            -1.49070100
            -RN     0
            RN-ECP     3     60
            f potential
              4
            2      6.34857100            21.79729000
            2      6.29594900            28.94680500
            2      2.88211800             1.44736500
            2      2.90804800             2.17796400
            s-f potential
              7
            2     30.15124200            49.96555100
            2     14.52124100           283.07000000
            2      8.05203800            62.00287000
            2      6.34857100           -21.79729000
            2      6.29594900           -28.94680500
            2      2.88211800            -1.44736500
            2      2.90804800            -2.17796400
            p-f potential
              8
            2     11.00994200            71.96911900
            2      9.61762500           143.86055900
            2      7.33600800             4.71476100
            2      6.40625300             9.01306500
            2      6.34857100           -21.79729000
            2      6.29594900           -28.94680500
            2      2.88211800            -1.44736500
            2      2.90804800            -2.17796400
            d-f potential
              8
            2      8.36922000            36.36836500
            2      8.11697500            54.55176100
            2      5.35365600             9.63448700
            2      5.09721200            14.38790200
            2      6.34857100           -21.79729000
            2      6.29594900           -28.94680500
            2      2.88211800            -1.44736500
            2      2.90804800            -2.17796400
            
 Initial command:
 /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe "/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/New_Molecules/B3LYPDBJ_def2SVPD/Gau-98850.inp" -scrdir="/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/New_Molecules/B3LYPDBJ_def2SVPD/"
 Entering Link 1 = /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe PID=     98851.
  
 Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2016,
            Gaussian, Inc.  All Rights Reserved.
  
 This is part of the Gaussian(R) 16 program.  It is based on
 the Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.),
 the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.),
 the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.),
 the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.),
 the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.),
 the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.),
 the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.),
 the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon
 University), and the Gaussian 82(TM) system (copyright 1983,
 Carnegie Mellon University). Gaussian is a federally registered
 trademark of Gaussian, Inc.
  
 This software contains proprietary and confidential information,
 including trade secrets, belonging to Gaussian, Inc.
  
 This software is provided under written license and may be
 used, copied, transmitted, or stored only in accord with that
 written license.
  
 The following legend is applicable only to US Government
 contracts under FAR:
  
                    RESTRICTED RIGHTS LEGEND
  
 Use, reproduction and disclosure by the US Government is
 subject to restrictions as set forth in subparagraphs (a)
 and (c) of the Commercial Computer Software - Restricted
 Rights clause in FAR 52.227-19.
  
 Gaussian, Inc.
 340 Quinnipiac St., Bldg. 40, Wallingford CT 06492
  
  
 ---------------------------------------------------------------
 Warning -- This program may not be used in any manner that
 competes with the business of Gaussian, Inc. or will provide
 assistance to any competitor of Gaussian, Inc.  The licensee
 of this program is prohibited from giving any competitor of
 Gaussian, Inc. access to this program.  By using this program,
 the user acknowledges that Gaussian, Inc. is engaged in the
 business of creating and licensing software in the field of
 computational chemistry and represents and warrants to the
 licensee that it is not a competitor of Gaussian, Inc. and that
 it will not use this program in any manner prohibited above.
 ---------------------------------------------------------------
  

 Cite this work as:
 Gaussian 16, Revision A.03,
 M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, 
 M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, 
 G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. V. Marenich, 
 J. Bloino, B. G. Janesko, R. Gomperts, B. Mennucci, H. P. Hratchian, 
 J. V. Ortiz, A. F. Izmaylov, J. L. Sonnenberg, D. Williams-Young, 
 F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, 
 T. Henderson, D. Ranasinghe, V. G. Zakrzewski, J. Gao, N. Rega, 
 G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, 
 J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, 
 T. Vreven, K. Throssell, J. A. Montgomery, Jr., J. E. Peralta, 
 F. Ogliaro, M. J. Bearpark, J. J. Heyd, E. N. Brothers, K. N. Kudin, 
 V. N. Staroverov, T. A. Keith, R. Kobayashi, J. Normand, 
 K. Raghavachari, A. P. Rendell, J. C. Burant, S. S. Iyengar, 
 J. Tomasi, M. Cossi, J. M. Millam, M. Klene, C. Adamo, R. Cammi, 
 J. W. Ochterski, R. L. Martin, K. Morokuma, O. Farkas, 
 J. B. Foresman, and D. J. Fox, Gaussian, Inc., Wallingford CT, 2016.
 
 ******************************************
 Gaussian 16:  ES64L-G16RevA.03 25-Dec-2016
                12-Aug-2021 
 ******************************************
 %NoSave
 %nproc=8
 Will use up to    8 processors via shared memory.
 %mem=40GB
 %chk=31_naproxen_conformer03_STD_B3LYPDBJ_def2SVPD
 ----------------------------------------------------------------------
 #P B3LYP/Gen EmpiricalDispersion=GD3BJ Integral=UltraFineGrid SCF=(NoS
 ymm,MaxCyc=120) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq
 ----------------------------------------------------------------------
 1/29=2,38=1,83=21,172=1/1;
 2/12=2,40=1/2;
 3/5=7,11=2,14=-4,25=1,30=1,36=2,74=-5,75=-5,116=-2,124=41/1,2,3;
 4/5=1,9=2/1;
 5/5=2,7=120,38=6,98=1/2;
 8/6=4,10=90,11=11/1;
 10/13=10,49=112,72=3/2;
 6/7=2,8=2,9=2,10=2,28=1/1;
 7/8=1,25=21/16;
 99/5=1/99;
 Leave Link    1 at Thu Aug 12 20:42:52 2021, MaxMem=  5368709120 cpu:               0.6 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l101.exe)
 -----------------
 ROA calculations.
 -----------------
 Structure from the checkpoint file:  "31_naproxen_conformer03_STD_B3LYPDBJ_def2SVPD.chk"
 Charge =  0 Multiplicity = 1
 No Z-Matrix found in chk file; cartesian coordinates used.
  C                                                 0.534503000000     -0.540241000000      0.250726000000
  C                                                 1.208047000000      0.686254000000     -0.018994000000
  C                                                -0.871111000000     -0.548582000000      0.352837000000
  C                                                -1.615360000000      0.600511000000      0.194237000000
  C                                                -0.937903000000      1.810722000000     -0.077253000000
  C                                                 0.429321000000      1.854269000000     -0.179299000000
  C                                                 1.312272000000     -1.716102000000      0.408925000000
  H                                                -1.366601000000     -1.491361000000      0.557454000000
  H                                                -1.515348000000      2.718805000000     -0.203162000000
  H                                                 0.928391000000      2.793066000000     -0.386339000000
  C                                                -3.123514000000      0.580399000000      0.330991000000
  C                                                -3.582702000000      0.341624000000      1.771049000000
  C                                                -3.808238000000     -0.400692000000     -0.629910000000
  H                                                -3.495206000000      1.561723000000      0.013814000000
  H                                                -3.241865000000     -0.630545000000      2.127829000000
  H                                                -4.668885000000      0.361293000000      1.833837000000
  H                                                -3.169487000000      1.109726000000      2.424876000000
  O                                                -4.830838000000     -0.974186000000     -0.383978000000
  O                                                -3.217917000000     -0.549143000000     -1.838643000000
  H                                                -2.355614000000     -0.107100000000     -1.835698000000
  C                                                 2.671053000000     -1.679537000000      0.307450000000
  C                                                 3.338655000000     -0.457152000000      0.039453000000
  C                                                 2.621063000000      0.703564000000     -0.121448000000
  O                                                 4.689861000000     -0.555418000000     -0.036901000000
  C                                                 5.432086000000      0.622962000000     -0.304199000000
  H                                                 0.808612000000     -2.652916000000      0.612592000000
  H                                                 3.271812000000     -2.571003000000      0.426688000000
  H                                                 3.110374000000      1.644342000000     -0.326736000000
  H                                                 5.158044000000      1.051824000000     -1.272282000000
  H                                                 6.476520000000      0.322638000000     -0.322951000000
  H                                                 5.281369000000      1.371486000000      0.478872000000
 Recover connectivity data from disk.
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 ITRead=  0  0  0  0  0  0  0  0  0  0  0
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 NAtoms=     31 NQM=       31 NQMF=       0 NMMI=      0 NMMIF=      0
                NMic=       0 NMicF=      0.
                    Isotopes and Nuclear Properties:
 (Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
  in nuclear magnetons)

  Atom         1           2           3           4           5           6           7           8           9          10
 IAtWgt=          12          12          12          12          12          12          12           1           1           1
 AtmWgt=  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000  12.0000000   1.0078250   1.0078250   1.0078250
 NucSpn=           0           0           0           0           0           0           0           1           1           1
 AtZEff=   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   3.6000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   2.7928460   2.7928460   2.7928460
 AtZNuc=   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   6.0000000   1.0000000   1.0000000   1.0000000

  Atom        11          12          13          14          15          16          17          18          19          20
 IAtWgt=          12          12          12           1           1           1           1          16          16           1
 AtmWgt=  12.0000000  12.0000000  12.0000000   1.0078250   1.0078250   1.0078250   1.0078250  15.9949146  15.9949146   1.0078250
 NucSpn=           0           0           0           1           1           1           1           0           0           1
 AtZEff=   3.6000000   3.6000000   3.6000000   1.0000000   1.0000000   1.0000000   1.0000000   5.6000000   5.6000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   0.0000000   0.0000000   2.7928460   2.7928460   2.7928460   2.7928460   0.0000000   0.0000000   2.7928460
 AtZNuc=   6.0000000   6.0000000   6.0000000   1.0000000   1.0000000   1.0000000   1.0000000   8.0000000   8.0000000   1.0000000

  Atom        21          22          23          24          25          26          27          28          29          30
 IAtWgt=          12          12          12          16          12           1           1           1           1           1
 AtmWgt=  12.0000000  12.0000000  12.0000000  15.9949146  12.0000000   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           0           0           0           0           0           1           1           1           1           1
 AtZEff=   3.6000000   3.6000000   3.6000000   5.6000000   3.6000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   6.0000000   6.0000000   6.0000000   8.0000000   6.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000

  Atom        31
 IAtWgt=           1
 AtmWgt=   1.0078250
 NucSpn=           1
 AtZEff=   1.0000000
 NQMom=    0.0000000
 NMagM=    2.7928460
 AtZNuc=   1.0000000
 Using perturbation frequencies:    0.088559
 Leave Link  101 at Thu Aug 12 20:42:52 2021, MaxMem=  5368709120 cpu:               0.8 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l202.exe)
                          Input orientation:                          
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0        0.534503   -0.540241    0.250726
      2          6           0        1.208047    0.686254   -0.018994
      3          6           0       -0.871111   -0.548582    0.352837
      4          6           0       -1.615360    0.600511    0.194237
      5          6           0       -0.937903    1.810722   -0.077253
      6          6           0        0.429321    1.854269   -0.179299
      7          6           0        1.312272   -1.716102    0.408925
      8          1           0       -1.366601   -1.491361    0.557454
      9          1           0       -1.515348    2.718805   -0.203162
     10          1           0        0.928391    2.793066   -0.386339
     11          6           0       -3.123514    0.580399    0.330991
     12          6           0       -3.582702    0.341624    1.771049
     13          6           0       -3.808238   -0.400692   -0.629910
     14          1           0       -3.495206    1.561723    0.013814
     15          1           0       -3.241865   -0.630545    2.127829
     16          1           0       -4.668885    0.361293    1.833837
     17          1           0       -3.169487    1.109726    2.424876
     18          8           0       -4.830838   -0.974186   -0.383978
     19          8           0       -3.217917   -0.549143   -1.838643
     20          1           0       -2.355614   -0.107100   -1.835698
     21          6           0        2.671053   -1.679537    0.307450
     22          6           0        3.338655   -0.457152    0.039453
     23          6           0        2.621063    0.703564   -0.121448
     24          8           0        4.689861   -0.555418   -0.036901
     25          6           0        5.432086    0.622962   -0.304199
     26          1           0        0.808612   -2.652916    0.612592
     27          1           0        3.271812   -2.571003    0.426688
     28          1           0        3.110374    1.644342   -0.326736
     29          1           0        5.158044    1.051824   -1.272282
     30          1           0        6.476520    0.322638   -0.322951
     31          1           0        5.281369    1.371486    0.478872
 ---------------------------------------------------------------------
                    Distance matrix (angstroms):
                    1          2          3          4          5
     1  C    0.000000
     2  C    1.425026   0.000000
     3  C    1.409343   2.446625   0.000000
     4  C    2.434423   2.832745   1.378215   0.000000
     5  C    2.793309   2.423412   2.399115   1.413246   0.000000
     6  C    2.435090   1.412930   2.783520   2.427377   1.371718
     7  C    1.418662   2.442395   2.476572   3.739494   4.211668
     8  H    2.147768   3.420981   1.084532   2.137694   3.389747
     9  H    3.876762   3.403243   3.376388   2.157568   1.083472
    10  H    3.416421   2.156805   3.866678   3.408084   2.131569
    11  C    3.826665   4.346966   2.519602   1.514475   2.541113
    12  C    4.476656   5.125846   3.186929   2.534520   3.545339
    13  C    4.433328   5.168925   3.100706   2.547615   3.665325
    14  H    4.551147   4.784152   3.384405   2.119033   2.571010
    15  H    4.218131   5.113172   2.962733   2.810657   4.016268
    16  H    5.513098   6.170649   4.176640   3.474123   4.435463
    17  H    4.600963   5.031365   3.510821   2.765929   3.425202
    18  O    5.420151   6.273628   4.050120   3.626748   4.796325
    19  O    4.294904   4.942316   3.210932   2.832401   3.724234
    20  H    3.590759   4.077929   2.681108   2.273615   2.963119
    21  C    2.421995   2.800700   3.718608   4.856416   5.035322
    22  C    2.813327   2.418736   4.222404   5.068025   4.842089
    23  C    2.457498   1.416831   3.740066   4.249418   3.727464
    24  O    4.165328   3.696633   5.574617   6.414469   6.105078
    25  C    5.064317   4.234130   6.444727   7.065086   6.483752
    26  H    2.160898   3.421769   2.705026   4.078658   4.842547
    27  H    3.412890   3.881685   4.610797   5.830693   6.097144
    28  H    3.426511   2.152089   4.595972   4.867603   4.059368
    29  H    5.121656   4.160150   6.446163   6.945024   6.258162
    30  H    6.031686   5.289746   7.429899   8.113151   7.566269
    31  H    5.122449   4.160453   6.446360   6.945523   6.259517
                    6          7          8          9         10
     6  C    0.000000
     7  C    3.724669   0.000000
     8  H    3.867994   2.692384   0.000000
     9  H    2.128316   5.295138   4.280906   0.000000
    10  H    1.083179   4.594824   4.951166   2.451720   0.000000
    11  C    3.808645   4.995617   2.725843   2.728424   4.672086
    12  C    4.710444   5.481823   3.121498   3.717856   5.569008
    13  C    4.821287   5.387866   2.925916   3.894961   5.717960
    14  H    3.940151   5.831989   3.761360   2.303422   4.609180
    15  H    4.997474   4.987307   2.593009   4.430861   5.952578
    16  H    5.680968   6.490006   3.995818   4.433060   6.494013
    17  H    4.504164   5.668821   3.674686   3.497413   5.246825
    18  O    5.975895   6.238344   3.626941   4.966221   6.881926
    19  O    4.672489   5.189987   3.171187   4.031504   5.520092
    20  H    3.787676   4.591362   2.936239   3.370009   4.614791
    21  C    4.213083   1.363055   4.049761   6.093611   4.849989
    22  C    3.722196   2.414061   4.845343   5.805765   4.068733
    23  C    2.476126   2.801609   4.602181   4.601931   2.702096
    24  O    4.896843   3.599174   6.157108   7.018034   5.048080
    25  C    5.153579   4.790891   7.171817   7.257383   4.999937
    26  H    4.591914   1.082947   2.466536   5.909453   5.538134
    27  H    5.294337   2.137982   4.764200   7.162100   5.909811
    28  H    2.693298   3.881617   5.536942   4.750478   2.466611
    29  H    4.919284   5.027707   7.237867   6.961035   4.659054
    30  H    6.239803   5.600139   8.098164   8.344215   6.073612
    31  H    4.920227   5.029098   7.238617   6.962457   4.660246
                   11         12         13         14         15
    11  C    0.000000
    12  C    1.530240   0.000000
    13  C    1.534509   2.523193   0.000000
    14  H    1.096245   2.141068   2.088885   0.000000
    15  H    2.170027   1.090218   2.824665   3.056024   0.000000
    16  H    2.166731   1.088174   2.718710   2.476093   1.762544
    17  H    2.160244   1.090054   3.467143   2.474594   1.766923
    18  O    2.417203   2.816619   1.197952   2.893611   2.992006
    19  O    2.447874   3.735828   1.353348   2.822099   3.967379
    20  H    2.399347   3.836108   1.910559   2.739404   4.094995
    21  C    6.219716   6.733251   6.670480   6.972427   6.275091
    22  C    6.551422   7.179251   7.178392   7.125880   6.906129
    23  C    5.763682   6.496095   6.543228   6.177660   6.419737
    24  O    7.904066   8.515202   8.520169   8.454595   8.222164
    25  C    8.579252   9.254848   9.302556   8.982146   9.095244
    26  H    5.098553   5.439939   5.285038   6.053476   4.774127
    27  H    7.130266   7.568029   7.480224   7.939926   7.006229
    28  H    6.358140   7.134076   7.220891   6.614869   7.179898
    29  H    8.448487   9.282612   9.105858   8.763149   9.216810
    30  H    9.625733  10.274879  10.314731  10.054057  10.067864
    31  H    8.443326   9.016767   9.326895   8.790946   8.909136
                   16         17         18         19         20
    16  H    0.000000
    17  H    1.776984   0.000000
    18  O    2.593923   3.872007   0.000000
    19  O    4.052322   4.575127   2.213194   0.000000
    20  H    4.363038   4.505058   2.997676   0.969008   0.000000
    21  C    7.769783   6.809948   7.566635   6.368946   5.686213
    22  C    8.246840   7.106424   8.196782   6.820876   6.005283
    23  C    7.555371   6.338707   7.642944   6.213833   5.325706
    24  O    9.587812   8.402524   9.536222   8.110442   7.285285
    25  C   10.328082   9.037248  10.386763   8.862895   7.970367
    26  H    6.370233   5.767766   5.967804   5.162107   4.742112
    27  H    8.580973   7.683154   8.298189   7.164930   6.546536
    28  H    8.175033   6.877051   8.361986   6.866186   5.934774
    29  H   10.329247   9.111537  10.230912   8.546378   7.623359
    30  H   11.352237  10.060592  11.381644   9.850860   8.971046
    31  H   10.092768   8.675968  10.416497   9.016516   8.115846
                   21         22         23         24         25
    21  C    0.000000
    22  C    1.418358   0.000000
    23  C    2.421905   1.374078   0.000000
    24  O    2.336195   1.356924   2.423243   0.000000
    25  C    3.646768   2.380587   2.818110   1.418071   0.000000
    26  H    2.123503   3.398674   3.884553   4.459309   5.740069
    27  H    1.081592   2.150066   3.383300   2.507660   3.924588
    28  H    3.412238   2.145340   1.080107   2.723551   2.536547
    29  H    4.017588   2.703301   2.807486   2.080526   1.093712
    30  H    4.345997   3.253553   3.879466   2.011208   1.086917
    31  H    4.018940   2.703913   2.807798   2.080592   1.093711
                   26         27         28         29         30
    26  H    0.000000
    27  H    2.471563   0.000000
    28  H    4.964562   4.285189   0.000000
    29  H    6.016262   4.423714   2.331971   0.000000
    30  H    6.469493   4.382382   3.616332   1.780820   0.000000
    31  H    6.018243   4.425411   2.331668   1.784358   1.780839
                   31
    31  H    0.000000
 Stoichiometry    C14H14O3
 Framework group  C1[X(C14H14O3)]
 Deg. of freedom    87
 Full point group                 C1      NOp   1
 RotChk:  IX=0 Diff= 4.39D-16
 Largest Abelian subgroup         C1      NOp   1
 Largest concise Abelian subgroup C1      NOp   1
                         Standard orientation:                         
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0        0.534503   -0.540241    0.250726
      2          6           0        1.208047    0.686254   -0.018994
      3          6           0       -0.871111   -0.548582    0.352837
      4          6           0       -1.615360    0.600511    0.194237
      5          6           0       -0.937903    1.810722   -0.077253
      6          6           0        0.429321    1.854269   -0.179299
      7          6           0        1.312272   -1.716102    0.408925
      8          1           0       -1.366601   -1.491361    0.557454
      9          1           0       -1.515348    2.718805   -0.203162
     10          1           0        0.928391    2.793066   -0.386339
     11          6           0       -3.123514    0.580399    0.330991
     12          6           0       -3.582702    0.341624    1.771049
     13          6           0       -3.808238   -0.400692   -0.629910
     14          1           0       -3.495206    1.561723    0.013814
     15          1           0       -3.241865   -0.630545    2.127829
     16          1           0       -4.668885    0.361293    1.833837
     17          1           0       -3.169487    1.109726    2.424876
     18          8           0       -4.830838   -0.974186   -0.383978
     19          8           0       -3.217917   -0.549143   -1.838643
     20          1           0       -2.355614   -0.107100   -1.835698
     21          6           0        2.671053   -1.679537    0.307450
     22          6           0        3.338655   -0.457152    0.039453
     23          6           0        2.621063    0.703564   -0.121448
     24          8           0        4.689861   -0.555418   -0.036901
     25          6           0        5.432086    0.622962   -0.304199
     26          1           0        0.808612   -2.652916    0.612592
     27          1           0        3.271812   -2.571003    0.426688
     28          1           0        3.110374    1.644342   -0.326736
     29          1           0        5.158044    1.051824   -1.272282
     30          1           0        6.476520    0.322638   -0.322951
     31          1           0        5.281369    1.371486    0.478872
 ---------------------------------------------------------------------
 Rotational constants (GHZ):           1.3250595           0.2107099           0.2001932
 Leave Link  202 at Thu Aug 12 20:42:52 2021, MaxMem=  5368709120 cpu:               0.1 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l301.exe)
 General basis read from cards:  (5D, 7F)
 Centers:       8      9     10     14     15     16     17     20     26     27
 Centers:      28     29     30     31
 S 3 1.00
     Exponent=  1.3010701000D+01 Coefficients=  1.9682158000D-02
     Exponent=  1.9622572000D+00 Coefficients=  1.3796524000D-01
     Exponent=  4.4453796000D-01 Coefficients=  4.7831935000D-01
 S 1 1.00
     Exponent=  1.2194962000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  8.0000000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  1.1704099050D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       1      2      3      4      5      6      7     11     12     13
 Centers:      21     22     23     25
 S 5 1.00
     Exponent=  1.2384016938D+03 Coefficients=  5.4568832082D-03
     Exponent=  1.8629004992D+02 Coefficients=  4.0638409211D-02
     Exponent=  4.2251176346D+01 Coefficients=  1.8025593888D-01
     Exponent=  1.1676557932D+01 Coefficients=  4.6315121755D-01
     Exponent=  3.5930506482D+00 Coefficients=  4.4087173314D-01
 S 1 1.00
     Exponent=  4.0245147363D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  1.3090182668D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  6.7053540256D-02 Coefficients=  1.0000000000D+00
 P 3 1.00
     Exponent=  9.4680970621D+00 Coefficients=  3.8387871728D-02
     Exponent=  2.0103545142D+00 Coefficients=  2.1117025112D-01
     Exponent=  5.4771004707D-01 Coefficients=  5.1328172114D-01
 P 1 1.00
     Exponent=  1.5268613795D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  8.0000000000D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.1713185140D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:      18     19     24
 S 5 1.00
     Exponent=  2.2661767785D+03 Coefficients= -5.3431809926D-03
     Exponent=  3.4087010191D+02 Coefficients= -3.9890039230D-02
     Exponent=  7.7363135167D+01 Coefficients= -1.7853911985D-01
     Exponent=  2.1479644940D+01 Coefficients= -4.6427684959D-01
     Exponent=  6.6589433124D+00 Coefficients= -4.4309745172D-01
 S 1 1.00
     Exponent=  8.0975975668D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  2.5530772234D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  7.6572453250D-02 Coefficients=  1.0000000000D+00
 P 3 1.00
     Exponent=  1.7721504317D+01 Coefficients=  4.3394573193D-02
     Exponent=  3.8635505440D+00 Coefficients=  2.3094120765D-01
     Exponent=  1.0480920883D+00 Coefficients=  5.1375311064D-01
 P 1 1.00
     Exponent=  2.7641544411D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  6.9002276350D-02 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.2000000000D+00 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.7992024323D-01 Coefficients=  1.0000000000D+00
 ****
 Ernie: Thresh=  0.10000D-02 Tol=  0.10000D-05 Strict=F.
 There are   495 symmetry adapted cartesian basis functions of A   symmetry.
 There are   461 symmetry adapted basis functions of A   symmetry.
   461 basis functions,   693 primitive gaussians,   495 cartesian basis functions
    61 alpha electrons       61 beta electrons
       nuclear repulsion energy      1136.4794098437 Hartrees.
 IExCor=  402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX=  0.200000
 ScaDFX=  0.800000  0.720000  1.000000  0.810000 ScalE2=  1.000000  1.000000
 IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=141
 NAtoms=   31 NActive=   31 NUniq=   31 SFac= 1.00D+00 NAtFMM=   60 NAOKFM=F Big=F
 Integral buffers will be    131072 words long.
 Raffenetti 2 integral format.
 Two-electron integral symmetry is turned on.
 R6Disp:  Grimme-D3(BJ) Dispersion energy=       -0.0643958060 Hartrees.
 Nuclear repulsion after empirical dispersion term =     1136.4150140377 Hartrees.
 Leave Link  301 at Thu Aug 12 20:42:53 2021, MaxMem=  5368709120 cpu:               4.1 elap:               0.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l302.exe)
 NPDir=0 NMtPBC=     1 NCelOv=     1 NCel=       1 NClECP=     1 NCelD=      1
         NCelK=      1 NCelE2=     1 NClLst=     1 CellRange=     0.0.
 One-electron integrals computed using PRISM.
 One-electron integral symmetry used in STVInt
 NBasis=   461 RedAO= T EigKep=  4.34D-06  NBF=   461
 NBsUse=   461 1.00D-06 EigRej= -1.00D+00 NBFU=   461
 Precomputing XC quadrature grid using
 IXCGrd= 4 IRadAn=           5 IRanWt=          -1 IRanGd=           0 AccXCQ= 0.00D+00.
 Generated NRdTot=       0 NPtTot=           0 NUsed=           0 NTot=          32
 NSgBfM=   493   493   493   493   493 MxSgAt=    31 MxSgA2=    31.
 Leave Link  302 at Thu Aug 12 20:42:53 2021, MaxMem=  5368709120 cpu:               3.8 elap:               0.5
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l303.exe)
 DipDrv:  MaxL=2.
 Leave Link  303 at Thu Aug 12 20:42:53 2021, MaxMem=  5368709120 cpu:               0.6 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l401.exe)
 Initial guess from the checkpoint file:  "31_naproxen_conformer03_STD_B3LYPDBJ_def2SVPD.chk"
 SCF N**3 symmetry information disabled.
 B after Tr=    -0.000000   -0.000000   -0.000000
         Rot=    1.000000    0.000000    0.000000   -0.000000 Ang=   0.00 deg.
 Guess basis will be translated and rotated to current coordinates.
 JPrj=2 DoOrth=T DoCkMO=T.
 Leave Link  401 at Thu Aug 12 20:42:54 2021, MaxMem=  5368709120 cpu:               4.6 elap:               0.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l502.exe)
 Integral symmetry usage will be decided dynamically.
 Closed shell SCF:
 Using DIIS extrapolation, IDIIS=  1040.
 NGot=  5368709120 LenX=  5368210351 LenY=  5367964831
 Requested convergence on RMS density matrix=1.00D-08 within 120 cycles.
 Requested convergence on MAX density matrix=1.00D-06.
 Requested convergence on             energy=1.00D-06.
 No special actions if energy rises.
 Fock matrices will be formed incrementally for  20 cycles.

 Cycle   1  Pass 1  IDiag  1:
 FoFJK:  IHMeth= 1 ICntrl=       0 DoSepK=F KAlg= 0 I1Cent=           0 FoldK=F
 IRaf= 910000000 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=F FulRan=T
         wScrn=  0.000000 ICntrl=         0 IOpCl=  0 I1Cent=           0 NGrid=           0
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 E= -767.155562850499    
 DIIS: error= 2.63D-03 at cycle   1 NSaved=   1.
 NSaved= 1 IEnMin= 1 EnMin= -767.155562850499     IErMin= 1 ErrMin= 2.63D-03
 ErrMax= 2.63D-03  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.34D-02 BMatP= 1.34D-02
 IDIUse=3 WtCom= 9.74D-01 WtEn= 2.63D-02
 Coeff-Com:  0.100D+01
 Coeff-En:   0.100D+01
 Coeff:      0.100D+01
 Gap=     0.168 Goal=   None    Shift=    0.000
 GapD=    0.168 DampG=1.000 DampE=1.000 DampFc=1.0000 IDamp=-1.
 RMSDP=1.62D-02 MaxDP=7.58D-01              OVMax= 1.48D-02

 Cycle   2  Pass 1  IDiag  1:
 RMSU=  1.34D-02    CP:  1.27D+00
 E= -767.166896316396     Delta-E=       -0.011333465897 Rises=F Damp=F
 DIIS: error= 6.94D-04 at cycle   2 NSaved=   2.
 NSaved= 2 IEnMin= 2 EnMin= -767.166896316396     IErMin= 2 ErrMin= 6.94D-04
 ErrMax= 6.94D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 6.43D-04 BMatP= 1.34D-02
 IDIUse=3 WtCom= 9.93D-01 WtEn= 6.94D-03
 Coeff-Com:  0.589D-01 0.941D+00
 Coeff-En:   0.000D+00 0.100D+01
 Coeff:      0.584D-01 0.942D+00
 Gap=     0.169 Goal=   None    Shift=    0.000
 RMSDP=8.11D-04 MaxDP=3.95D-02 DE=-1.13D-02 OVMax= 8.17D-03

 Cycle   3  Pass 1  IDiag  1:
 RMSU=  3.04D-04    CP:  1.28D+00  1.04D+00
 E= -767.166469700158     Delta-E=        0.000426616238 Rises=F Damp=F
 DIIS: error= 1.10D-03 at cycle   3 NSaved=   3.
 NSaved= 3 IEnMin= 2 EnMin= -767.166896316396     IErMin= 2 ErrMin= 6.94D-04
 ErrMax= 1.10D-03  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.27D-03 BMatP= 6.43D-04
 IDIUse=3 WtCom= 2.31D-01 WtEn= 7.69D-01
 Coeff-Com: -0.149D-01 0.591D+00 0.424D+00
 Coeff-En:   0.000D+00 0.630D+00 0.370D+00
 Coeff:     -0.344D-02 0.621D+00 0.382D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=1.44D-04 MaxDP=5.66D-03 DE= 4.27D-04 OVMax= 5.89D-03

 Cycle   4  Pass 1  IDiag  1:
 RMSU=  1.13D-04    CP:  1.28D+00  1.04D+00  7.16D-01
 E= -767.167389859683     Delta-E=       -0.000920159525 Rises=F Damp=F
 DIIS: error= 1.26D-04 at cycle   4 NSaved=   4.
 NSaved= 4 IEnMin= 4 EnMin= -767.167389859683     IErMin= 4 ErrMin= 1.26D-04
 ErrMax= 1.26D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.09D-05 BMatP= 6.43D-04
 IDIUse=3 WtCom= 9.99D-01 WtEn= 1.26D-03
 Coeff-Com: -0.105D-01 0.300D+00 0.200D+00 0.510D+00
 Coeff-En:   0.000D+00 0.000D+00 0.000D+00 0.100D+01
 Coeff:     -0.105D-01 0.300D+00 0.199D+00 0.511D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=6.95D-05 MaxDP=3.95D-03 DE=-9.20D-04 OVMax= 1.62D-03

 Cycle   5  Pass 1  IDiag  1:
 RMSU=  4.47D-05    CP:  1.28D+00  1.04D+00  6.65D-01  7.76D-01
 E= -767.167409135391     Delta-E=       -0.000019275708 Rises=F Damp=F
 DIIS: error= 4.39D-05 at cycle   5 NSaved=   5.
 NSaved= 5 IEnMin= 5 EnMin= -767.167409135391     IErMin= 5 ErrMin= 4.39D-05
 ErrMax= 4.39D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.35D-06 BMatP= 2.09D-05
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.438D-02 0.104D+00 0.687D-01 0.274D+00 0.557D+00
 Coeff:     -0.438D-02 0.104D+00 0.687D-01 0.274D+00 0.557D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=1.79D-05 MaxDP=8.00D-04 DE=-1.93D-05 OVMax= 5.95D-04

 Cycle   6  Pass 1  IDiag  1:
 RMSU=  1.26D-05    CP:  1.28D+00  1.04D+00  6.70D-01  8.05D-01  7.90D-01
 E= -767.167410767772     Delta-E=       -0.000001632381 Rises=F Damp=F
 DIIS: error= 1.97D-05 at cycle   6 NSaved=   6.
 NSaved= 6 IEnMin= 6 EnMin= -767.167410767772     IErMin= 6 ErrMin= 1.97D-05
 ErrMax= 1.97D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 6.09D-07 BMatP= 2.35D-06
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.792D-03 0.920D-02 0.656D-02 0.746D-01 0.364D+00 0.546D+00
 Coeff:     -0.792D-03 0.920D-02 0.656D-02 0.746D-01 0.364D+00 0.546D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=6.90D-06 MaxDP=3.31D-04 DE=-1.63D-06 OVMax= 2.51D-04

 Cycle   7  Pass 1  IDiag  1:
 RMSU=  4.27D-06    CP:  1.28D+00  1.04D+00  6.76D-01  7.99D-01  7.92D-01
                    CP:  6.98D-01
 E= -767.167411294513     Delta-E=       -0.000000526741 Rises=F Damp=F
 DIIS: error= 3.95D-06 at cycle   7 NSaved=   7.
 NSaved= 7 IEnMin= 7 EnMin= -767.167411294513     IErMin= 7 ErrMin= 3.95D-06
 ErrMax= 3.95D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.38D-08 BMatP= 6.09D-07
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.164D-03-0.716D-03-0.289D-03 0.225D-01 0.152D+00 0.275D+00
 Coeff-Com:  0.551D+00
 Coeff:     -0.164D-03-0.716D-03-0.289D-03 0.225D-01 0.152D+00 0.275D+00
 Coeff:      0.551D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=1.74D-06 MaxDP=6.22D-05 DE=-5.27D-07 OVMax= 5.45D-05

 Cycle   8  Pass 1  IDiag  1:
 RMSU=  1.14D-06    CP:  1.28D+00  1.04D+00  6.76D-01  7.98D-01  8.11D-01
                    CP:  6.67D-01  8.08D-01
 E= -767.167411309841     Delta-E=       -0.000000015328 Rises=F Damp=F
 DIIS: error= 1.91D-06 at cycle   8 NSaved=   8.
 NSaved= 8 IEnMin= 8 EnMin= -767.167411309841     IErMin= 8 ErrMin= 1.91D-06
 ErrMax= 1.91D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 6.07D-09 BMatP= 2.38D-08
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.426D-05-0.172D-02-0.113D-02 0.368D-02 0.450D-01 0.982D-01
 Coeff-Com:  0.365D+00 0.491D+00
 Coeff:      0.426D-05-0.172D-02-0.113D-02 0.368D-02 0.450D-01 0.982D-01
 Coeff:      0.365D+00 0.491D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=7.57D-07 MaxDP=3.43D-05 DE=-1.53D-08 OVMax= 2.92D-05

 Cycle   9  Pass 1  IDiag  1:
 RMSU=  5.04D-07    CP:  1.28D+00  1.04D+00  6.76D-01  8.01D-01  8.08D-01
                    CP:  6.85D-01  7.62D-01  7.23D-01
 E= -767.167411315189     Delta-E=       -0.000000005348 Rises=F Damp=F
 DIIS: error= 5.11D-07 at cycle   9 NSaved=   9.
 NSaved= 9 IEnMin= 9 EnMin= -767.167411315189     IErMin= 9 ErrMin= 5.11D-07
 ErrMax= 5.11D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.70D-10 BMatP= 6.07D-09
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.151D-04-0.852D-03-0.567D-03 0.497D-04 0.121D-01 0.294D-01
 Coeff-Com:  0.151D+00 0.255D+00 0.555D+00
 Coeff:      0.151D-04-0.852D-03-0.567D-03 0.497D-04 0.121D-01 0.294D-01
 Coeff:      0.151D+00 0.255D+00 0.555D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=2.36D-07 MaxDP=1.01D-05 DE=-5.35D-09 OVMax= 6.85D-06

 Cycle  10  Pass 1  IDiag  1:
 RMSU=  1.62D-07    CP:  1.28D+00  1.04D+00  6.76D-01  8.00D-01  8.08D-01
                    CP:  6.82D-01  7.79D-01  7.05D-01  7.58D-01
 E= -767.167411315416     Delta-E=       -0.000000000227 Rises=F Damp=F
 DIIS: error= 1.47D-07 at cycle  10 NSaved=  10.
 NSaved=10 IEnMin=10 EnMin= -767.167411315416     IErMin=10 ErrMin= 1.47D-07
 ErrMax= 1.47D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.00D-11 BMatP= 2.70D-10
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.805D-05-0.254D-03-0.167D-03-0.549D-03 0.729D-03 0.319D-02
 Coeff-Com:  0.393D-01 0.803D-01 0.317D+00 0.560D+00
 Coeff:      0.805D-05-0.254D-03-0.167D-03-0.549D-03 0.729D-03 0.319D-02
 Coeff:      0.393D-01 0.803D-01 0.317D+00 0.560D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=8.59D-08 MaxDP=3.28D-06 DE=-2.27D-10 OVMax= 2.10D-06

 Cycle  11  Pass 1  IDiag  1:
 RMSU=  5.77D-08    CP:  1.28D+00  1.04D+00  6.76D-01  8.00D-01  8.08D-01
                    CP:  6.83D-01  7.84D-01  6.98D-01  7.69D-01  7.11D-01
 E= -767.167411315471     Delta-E=       -0.000000000055 Rises=F Damp=F
 DIIS: error= 3.20D-08 at cycle  11 NSaved=  11.
 NSaved=11 IEnMin=11 EnMin= -767.167411315471     IErMin=11 ErrMin= 3.20D-08
 ErrMax= 3.20D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.06D-12 BMatP= 4.00D-11
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.259D-05-0.519D-04-0.327D-04-0.277D-03-0.604D-03-0.891D-03
 Coeff-Com:  0.681D-02 0.175D-01 0.106D+00 0.264D+00 0.607D+00
 Coeff:      0.259D-05-0.519D-04-0.327D-04-0.277D-03-0.604D-03-0.891D-03
 Coeff:      0.681D-02 0.175D-01 0.106D+00 0.264D+00 0.607D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=2.30D-08 MaxDP=1.00D-06 DE=-5.48D-11 OVMax= 5.85D-07

 Cycle  12  Pass 1  IDiag  1:
 RMSU=  1.55D-08    CP:  1.28D+00  1.04D+00  6.76D-01  8.00D-01  8.08D-01
                    CP:  6.83D-01  7.83D-01  7.03D-01  7.72D-01  7.36D-01
                    CP:  7.79D-01
 E= -767.167411315473     Delta-E=       -0.000000000002 Rises=F Damp=F
 DIIS: error= 1.78D-08 at cycle  12 NSaved=  12.
 NSaved=12 IEnMin=12 EnMin= -767.167411315473     IErMin=12 ErrMin= 1.78D-08
 ErrMax= 1.78D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 3.98D-13 BMatP= 2.06D-12
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.586D-06-0.186D-05 0.951D-09-0.987D-04-0.404D-03-0.843D-03
 Coeff-Com: -0.328D-03 0.845D-03 0.250D-01 0.859D-01 0.348D+00 0.542D+00
 Coeff:      0.586D-06-0.186D-05 0.951D-09-0.987D-04-0.404D-03-0.843D-03
 Coeff:     -0.328D-03 0.845D-03 0.250D-01 0.859D-01 0.348D+00 0.542D+00
 Gap=     0.168 Goal=   None    Shift=    0.000
 RMSDP=8.18D-09 MaxDP=3.87D-07 DE=-1.82D-12 OVMax= 3.33D-07

 SCF Done:  E(RB3LYP) =  -767.167411315     A.U. after   12 cycles
            NFock= 12  Conv=0.82D-08     -V/T= 2.0107
 KE= 7.590759504950D+02 PE=-4.055482910148D+03 EE= 1.392824534300D+03
 Leave Link  502 at Thu Aug 12 20:46:21 2021, MaxMem=  5368709120 cpu:            1646.9 elap:             206.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l801.exe)
 DoSCS=F DFT=T ScalE2(SS,OS)=  1.000000  1.000000
 Range of M.O.s used for correlation:     1   461
 NBasis=   461 NAE=    61 NBE=    61 NFC=     0 NFV=     0
 NROrb=    461 NOA=    61 NOB=    61 NVA=   400 NVB=   400

 **** Warning!!: The largest alpha MO coefficient is  0.53937094D+02

 Leave Link  801 at Thu Aug 12 20:46:21 2021, MaxMem=  5368709120 cpu:               0.3 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1002.exe)
 Minotr:  Closed shell wavefunction.
          Direct CPHF calculation.
          Differentiating once with respect to electric field.
                with respect to dipole field.
                with respect to quadrupole field.
          Differentiating once with respect to magnetic field using GIAOs.
          Electric field/nuclear overlap derivatives assumed to be zero.
          Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
          Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
          NewPWx=F KeepS1=T KeepF1=T KeepIn=T MapXYZ=F SortEE=F KeepMc=T.
         9463 words used for storage of precomputed grid.
 Two-electron integral symmetry used by symmetrizing perturbed Fock matrices.
          MDV=    5368709120 using IRadAn=       1.
          Solving linear equations simultaneously, MaxMat=     384.
          Doing perturbations at frequencies    0.088559
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=T FulRan=T
         wScrn=  0.000000 ICntrl=      6100 IOpCl=  0 I1Cent=           7 NGrid=          31
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 FoFJK:  IHMeth= 1 ICntrl=    6127 DoSepK=F KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 CalDSu exits because no D1Ps are significant.
          There are    12 degrees of freedom in the 1st order CPHF.  IDoFFX=0 NUNeed=    12.
     11 vectors produced by pass  0 Test12= 4.07D-13 8.33D-09 XBig12= 1.00D+00 6.32D-01.
 AX will form    11 AO Fock derivatives at one time.
     11 vectors produced by pass  1 Test12= 4.07D-13 8.33D-09 XBig12= 4.81D-01 1.72D-01.
     11 vectors produced by pass  2 Test12= 4.07D-13 8.33D-09 XBig12= 1.09D-01 9.24D-02.
     11 vectors produced by pass  3 Test12= 4.07D-13 8.33D-09 XBig12= 1.71D-02 3.42D-02.
     11 vectors produced by pass  4 Test12= 4.07D-13 8.33D-09 XBig12= 6.34D-03 2.83D-02.
     11 vectors produced by pass  5 Test12= 4.07D-13 8.33D-09 XBig12= 5.31D-04 5.18D-03.
     11 vectors produced by pass  6 Test12= 4.07D-13 8.33D-09 XBig12= 2.21D-05 7.59D-04.
     11 vectors produced by pass  7 Test12= 4.07D-13 8.33D-09 XBig12= 1.12D-06 1.62D-04.
     11 vectors produced by pass  8 Test12= 4.07D-13 8.33D-09 XBig12= 2.67D-08 2.47D-05.
     11 vectors produced by pass  9 Test12= 4.07D-13 8.33D-09 XBig12= 8.81D-10 2.91D-06.
     10 vectors produced by pass 10 Test12= 4.07D-13 8.33D-09 XBig12= 1.58D-11 5.66D-07.
      7 vectors produced by pass 11 Test12= 4.07D-13 8.33D-09 XBig12= 3.50D-13 7.59D-08.
      1 vectors produced by pass 12 Test12= 4.07D-13 8.33D-09 XBig12= 7.03D-15 8.57D-09.
 InvSVY:  IOpt=1 It=  1 EMax= 4.26D-14
 Solved reduced A of dimension   128 with    12 vectors.
 FullF1:  Do perturbations      1 to      12.
 SCF Polarizability for W=    0.088559:
                1             2             3 
      1  0.303178D+03
      2 -0.125945D+02  0.177410D+03
      3 -0.102746D+02 -0.850368D+01  0.120356D+03
 Isotropic polarizability for W=    0.088559      200.31 Bohr**3.
 Dipole-quadrupole polarizability for W=    0.088559:
                 1             2             3 
      1   0.333339D+03 -0.957881D+02 -0.139768D+02
      2  -0.146176D+03  0.769781D+02 -0.115842D+02
      3  -0.187163D+03  0.188100D+02  0.255610D+02
      4  -0.190629D+02  0.123732D+03 -0.444837D+02
      5   0.465371D+02 -0.531838D+02 -0.656365D+02
      6  -0.262387D+02  0.405523D+02  0.247900D+02
 Dipole-magnetic dipole polarizability for W=    0.088559:
                 1             2             3 
      1  -0.111415D+02  0.194338D+02 -0.152319D+02
      2  -0.264150D+02 -0.132530D+02 -0.312428D+02
      3   0.499098D+02 -0.586642D+02  0.215607D+02
 DQ contribution to OR G for W=    0.088559:
                 1             2             3 
      1  -0.870002D+01  0.521366D+02 -0.598003D+01
      2  -0.605139D+02 -0.182451D+02  0.121527D+03
      3   0.767252D+02 -0.269907D+03  0.269451D+02
 Optical Rotation G' tensor for W=    0.088559:
                 1             2             3 
      1   0.197885D+01  0.698123D+00  0.173659D+00
      2   0.698123D+00  0.648381D+00  0.392916D+01
      3   0.173659D+00  0.392916D+01 -0.546097D+01
 OR G Eigenvalues:    -7.3856     1.5134     3.0385  Iso=     0.9446
 Eigenvectors:
   (1)   0.016187  -0.440416   0.897648
   (2)   0.832469  -0.491342  -0.256080
   (3)   0.553834   0.751410   0.358679
 w=    0.088559 a.u., Optical Rotation Beta=      0.9446 au.
 Molar Mass =    230.2628 grams/mole, [Alpha] ( 5145.0 A) =      208.01 deg.
 PxScal for PaGxPb-FJK:  IOpCl= 0 ISclPx=1 IMOff=     1 NMtTot=    25 NTT=  106491 ScalPx= 7.51D+01
 PxSclF for G(T1ab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=  106491 IRwP= 19996     0 IPTmp= 19977     0 ScalPx= 2.12D+03
 FullF1:  Do perturbations      1 to      30.
          There are    36 degrees of freedom in the 2nd order CPHF.
     30 vectors produced by pass  0 Test12= 6.78D-14 2.78D-09 XBig12= 1.00D+00 4.24D-01.
     30 vectors produced by pass  1 Test12= 6.78D-14 2.78D-09 XBig12= 9.70D-02 1.25D-01.
     30 vectors produced by pass  2 Test12= 6.78D-14 2.78D-09 XBig12= 3.98D-03 1.91D-02.
     30 vectors produced by pass  3 Test12= 6.78D-14 2.78D-09 XBig12= 1.51D-04 1.43D-03.
     30 vectors produced by pass  4 Test12= 6.78D-14 2.78D-09 XBig12= 2.99D-06 2.15D-04.
     30 vectors produced by pass  5 Test12= 6.78D-14 2.78D-09 XBig12= 5.58D-08 2.35D-05.
     30 vectors produced by pass  6 Test12= 6.78D-14 2.78D-09 XBig12= 5.12D-10 2.16D-06.
     30 vectors produced by pass  7 Test12= 6.78D-14 2.78D-09 XBig12= 2.19D-12 1.43D-07.
      4 vectors produced by pass  8 Test12= 6.78D-14 2.78D-09 XBig12= 7.57D-15 6.73D-09.
      3 vectors produced by pass  9 Test12= 6.78D-14 2.78D-09 XBig12= 2.31D-14 1.04D-08.
      3 vectors produced by pass 10 Test12= 6.78D-14 2.78D-09 XBig12= 5.77D-14 1.42D-08.
      3 vectors produced by pass 11 Test12= 6.78D-14 2.78D-09 XBig12= 2.39D-13 3.97D-08.
      2 vectors produced by pass 12 Test12= 6.78D-14 2.78D-09 XBig12= 5.75D-14 1.53D-08.
      1 vectors produced by pass 13 Test12= 6.78D-14 2.78D-09 XBig12= 2.97D-15 4.49D-09.
      1 vectors produced by pass 14 Test12= 6.78D-14 2.78D-09 XBig12= 2.29D-15 3.92D-09.
      1 vectors produced by pass 15 Test12= 6.78D-14 2.78D-09 XBig12= 1.54D-15 2.92D-09.
      1 vectors produced by pass 16 Test12= 6.78D-14 2.78D-09 XBig12= 2.48D-15 3.66D-09.
 InvSVY:  IOpt=1 It=  1 EMax= 2.44D-15
 Solved reduced A of dimension   259 with    30 vectors.
 PxScal for FxTab-FJK:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=  106491 ScalPx= 1.90D+03
 PxScal for FxTab-XC:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=  106491 ScalPx= 1.90D+03
 PxSclF for G(Xab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=  106491 IRwP= 19978     0 IPTmp= 19973     0 ScalPx= 1.53D+03
 FullF1:  Do perturbations      1 to      30.
 End of Minotr F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) frequency  1    0.088559:
                 1             2             3 
      1   0.303178D+03 -0.125945D+02 -0.102746D+02
      2  -0.125945D+02  0.177410D+03 -0.850368D+01
      3  -0.102746D+02 -0.850368D+01  0.120356D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.088559:
                 1             2             3 
      1  -0.111415D+02  0.194338D+02 -0.152319D+02
      2  -0.264150D+02 -0.132530D+02 -0.312428D+02
      3   0.499098D+02 -0.586642D+02  0.215607D+02
 Property number 4 -- D-Q polarizability frequency  1    0.088559:
                 1             2             3 
      1   0.333339D+03 -0.957881D+02 -0.139768D+02
      2  -0.146176D+03  0.769781D+02 -0.115842D+02
      3  -0.187163D+03  0.188100D+02  0.255610D+02
      4  -0.190629D+02  0.123732D+03 -0.444837D+02
      5   0.465371D+02 -0.531838D+02 -0.656365D+02
      6  -0.262387D+02  0.405523D+02  0.247900D+02
 End of Minotr F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    93 ND12= 1 LenFil=    3351:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.383744D+02  0.715836D+01  0.639873D+00 -0.353646D+02  0.106218D+02
      2   0.715836D+01 -0.338920D+01  0.867179D-01  0.106218D+02 -0.105763D+02
      3   0.639873D+00  0.867179D-01  0.110648D+00  0.145251D+00  0.114332D+01
                 6             7             8             9            10 
      1   0.145251D+00  0.941777D+01 -0.270299D+01 -0.799103D+00  0.466665D+02
      2   0.114332D+01 -0.270299D+01  0.175346D+01 -0.121312D+01 -0.103133D+02
      3   0.100254D+00 -0.799103D+00 -0.121312D+01  0.551895D+00 -0.733381D+00
                11            12            13            14            15 
      1  -0.103133D+02 -0.733381D+00  0.325231D+02 -0.888950D+01 -0.867073D-01
      2   0.696838D+01 -0.680623D+00 -0.888950D+01  0.853584D+01 -0.839936D+00
      3  -0.680623D+00 -0.146941D+00 -0.867073D-01 -0.839936D+00 -0.577068D-01
                16            17            18            19            20 
      1  -0.907375D+01  0.263758D+01  0.148025D+01  0.365638D+02 -0.740524D+01
      2   0.263758D+01 -0.174084D+01  0.958607D+00 -0.740524D+01  0.499295D+01
      3   0.148025D+01  0.958607D+00 -0.314372D+00 -0.284261D+00 -0.580804D+00
                21            22            23            24            25 
      1  -0.284261D+00 -0.281000D+02  0.428296D+01 -0.217916D+00  0.392940D+01
      2  -0.580804D+00  0.428296D+01 -0.558906D+01 -0.183052D+00 -0.854122D+00
      3   0.287781D+00 -0.217916D+00 -0.183052D+00 -0.189996D+01 -0.123135D+01
                26            27            28            29            30 
      1  -0.854122D+00 -0.123135D+01 -0.521906D+02  0.635133D+01  0.670632D+00
      2  -0.359253D+00 -0.288019D+01  0.635133D+01 -0.348457D+01 -0.244817D+00
      3  -0.288019D+01  0.174809D+01  0.670632D+00 -0.244817D+00 -0.223939D+01
                31            32            33            34            35 
      1   0.135273D+02 -0.192604D+01 -0.129379D+01 -0.442636D+01 -0.795467D+00
      2  -0.192604D+01  0.967941D+01 -0.139846D+01 -0.795467D+00 -0.871897D+00
      3  -0.129379D+01 -0.139846D+01  0.473649D+00 -0.671966D+01  0.118835D+01
                36            37            38            39            40 
      1  -0.671966D+01  0.183394D+01 -0.545603D+00  0.147307D+00  0.134128D+02
      2   0.118835D+01 -0.545603D+00 -0.980270D+01  0.168195D+01 -0.223751D+01
      3   0.383876D+00  0.147307D+00  0.168195D+01 -0.171137D+01 -0.618339D+00
                41            42            43            44            45 
      1  -0.223751D+01 -0.618339D+00 -0.319792D+01 -0.321576D+00 -0.504579D+01
      2  -0.116360D+01  0.132667D+01 -0.321576D+00  0.223504D+01  0.326573D+01
      3   0.132667D+01  0.153357D+01 -0.504579D+01  0.326573D+01 -0.875367D+00
                46            47            48            49            50 
      1   0.390083D+01 -0.159304D+01  0.107436D+00  0.285430D+01 -0.242416D+01
      2  -0.159304D+01  0.769875D+01 -0.596815D+00 -0.242416D+01  0.227435D+00
      3   0.107436D+00 -0.596815D+00  0.167828D+01  0.627391D+00  0.104748D+01
                51            52            53            54            55 
      1   0.627391D+00 -0.419973D+00  0.846491D+00  0.110618D+01 -0.111756D+02
      2   0.104748D+01  0.846491D+00  0.969384D+00  0.379934D+01  0.427010D+01
      3   0.742214D+00  0.110618D+01  0.379934D+01 -0.181821D+01 -0.198886D+00
                56            57            58            59            60 
      1   0.427010D+01 -0.198886D+00  0.222709D+01  0.119516D+00 -0.670277D+00
      2  -0.104479D+02  0.116333D+01  0.119516D+00  0.129791D+01 -0.115433D+01
      3   0.116333D+01 -0.166930D+01 -0.670277D+00 -0.115433D+01 -0.777561D+00
                61            62            63            64            65 
      1  -0.552853D-01 -0.912404D+00 -0.149086D+01 -0.244762D+01 -0.237245D+01
      2  -0.912404D+00 -0.824048D+00 -0.345681D+01 -0.237245D+01 -0.143679D+01
      3  -0.149086D+01 -0.345681D+01  0.193674D+01  0.583656D+00  0.330528D+00
                66            67            68            69            70 
      1   0.583656D+00 -0.322811D+01 -0.301892D+01  0.778436D+00  0.927577D+00
      2   0.330528D+00 -0.301892D+01 -0.504121D+01  0.102464D+01  0.727497D+00
      3  -0.440195D+00  0.778436D+00  0.102464D+01 -0.937312D+00 -0.209127D+00
                71            72            73            74            75 
      1   0.727497D+00 -0.209127D+00 -0.457032D+01  0.326814D+01 -0.247591D+00
      2   0.956937D+00 -0.337411D+00  0.326814D+01 -0.346171D+01  0.357772D+00
      3  -0.337411D+00  0.253822D+00 -0.247591D+00  0.357772D+00 -0.331532D+00
                76            77            78            79            80 
      1   0.359676D+01 -0.468597D+01  0.675828D+00 -0.313289D+00  0.743954D+00
      2  -0.468597D+01  0.800758D+01 -0.909556D+00  0.743954D+00 -0.113161D+01
      3   0.675828D+00 -0.909556D+00  0.808297D+00  0.357774D+00  0.343027D+00
                81            82            83            84            85 
      1   0.357774D+00  0.159685D+01  0.222260D+01 -0.481666D+00  0.117941D+01
      2   0.343027D+00  0.222260D+01  0.326876D+01 -0.665411D+00  0.251144D+01
      3  -0.226700D+00 -0.481666D+00 -0.665411D+00  0.434375D+00 -0.438528D+00
                86            87            88            89            90 
      1   0.251144D+01 -0.438528D+00 -0.232597D+00 -0.524391D+00  0.248657D+00
      2   0.916812D+01 -0.163783D+01 -0.524391D+00 -0.188438D+01  0.478062D+00
      3  -0.163783D+01  0.108617D+01  0.248657D+00  0.478062D+00 -0.299190D+00
                91            92            93            94            95 
      1   0.192773D+02 -0.190273D+01  0.291446D+00  0.579630D+01  0.875788D+00
      2  -0.190273D+01  0.170191D+01  0.736658D+00  0.875788D+00 -0.359892D+01
      3   0.291446D+00  0.736658D+00  0.311476D+01  0.436330D+00  0.183532D+01
                96            97            98            99           100 
      1   0.436330D+00 -0.243238D+01  0.142257D+01  0.842470D+01  0.942805D+01
      2   0.183532D+01  0.142257D+01  0.167212D+01 -0.930055D-01 -0.702894D+00
      3   0.118988D+01  0.842470D+01 -0.930055D-01 -0.166346D+01 -0.213403D+01
               101           102           103           104           105 
      1  -0.702894D+00 -0.213403D+01 -0.288970D+01 -0.160394D+01 -0.108510D+00
      2  -0.169338D+01 -0.542344D+00 -0.160394D+01  0.139870D+01 -0.355661D+01
      3  -0.542344D+00 -0.241006D+01 -0.108510D+00 -0.355661D+01 -0.155560D+01
               106           107           108           109           110 
      1   0.660288D+01 -0.105764D+01 -0.559574D+01  0.706796D+01  0.374881D+01
      2  -0.105764D+01 -0.235139D+01 -0.660418D+00  0.374881D+01  0.128547D+01
      3  -0.559574D+01 -0.660418D+00  0.269831D+01 -0.109536D+01 -0.276710D+00
               111           112           113           114           115 
      1  -0.109536D+01  0.832477D+00  0.146261D+01 -0.817001D+00 -0.981006D+01
      2  -0.276710D+00  0.146261D+01  0.654292D+00 -0.829747D+00 -0.146647D+01
      3  -0.102388D+01 -0.817001D+00 -0.829747D+00 -0.281410D+00 -0.444482D+01
               116           117           118           119           120 
      1  -0.146647D+01 -0.444482D+01 -0.521970D+00  0.211508D+01 -0.639597D+00
      2  -0.160187D+01 -0.109412D+00  0.211508D+01 -0.187844D+01  0.203561D-01
      3  -0.109412D+00  0.302193D+00 -0.639597D+00  0.203561D-01 -0.117826D+01
               121           122           123           124           125 
      1   0.429163D+01 -0.227827D+01  0.195818D+00 -0.125362D+01  0.149897D+00
      2  -0.227827D+01  0.601336D+01 -0.950107D+00  0.149897D+00 -0.132708D+01
      3   0.195818D+00 -0.950107D+00  0.137780D+01 -0.147239D+01  0.107524D+01
               126           127           128           129           130 
      1  -0.147239D+01  0.108829D+00 -0.641012D+00  0.171983D+00 -0.195822D+01
      2   0.107524D+01 -0.641012D+00  0.755946D+00 -0.262524D+00  0.235032D-01
      3  -0.426834D+00  0.171983D+00 -0.262524D+00  0.125503D+01  0.592389D+00
               131           132           133           134           135 
      1   0.235032D-01  0.592389D+00  0.203448D+00  0.113280D+00  0.241628D+00
      2  -0.397830D+01  0.222669D+01  0.113280D+00  0.154137D+01 -0.122795D+01
      3   0.222669D+01 -0.262728D+01  0.241628D+00 -0.122795D+01  0.181100D+01
               136           137           138           139           140 
      1  -0.163787D+02  0.847423D+00  0.395162D+01  0.477800D+00 -0.124959D+01
      2   0.847423D+00 -0.858932D+00 -0.308247D+00 -0.124959D+01  0.673802D-01
      3   0.395162D+01 -0.308247D+00 -0.247927D+01 -0.262306D+00  0.708985D+00
               141           142           143           144           145 
      1  -0.262306D+00  0.121994D+01  0.980015D-01 -0.122573D+01 -0.205015D+00
      2   0.708985D+00  0.980015D-01  0.100885D+00  0.107169D+00  0.813977D+00
      3   0.186711D+00 -0.122573D+01  0.107169D+00  0.373712D+00  0.769392D+00
               146           147           148           149           150 
      1   0.813977D+00  0.769392D+00  0.140837D+01  0.132483D+00 -0.280998D+00
      2   0.100120D+01  0.829524D+00  0.132483D+00  0.303760D+01  0.284810D+01
      3   0.829524D+00  0.200701D+01 -0.280998D+00  0.284810D+01  0.361514D+01
               151           152           153           154           155 
      1   0.542689D-01  0.587968D-01  0.266049D+00 -0.183234D+02 -0.466503D+01
      2   0.587968D-01  0.207617D+01  0.236699D+01 -0.466503D+01 -0.269885D+01
      3   0.266049D+00  0.236699D+01  0.444573D+01  0.405936D+00 -0.380449D+00
               156           157           158           159           160 
      1   0.405936D+00 -0.820247D+01 -0.551576D+01  0.264602D+00  0.872359D+00
      2  -0.380449D+00 -0.551576D+01 -0.406272D+01  0.308242D+00  0.507958D+00
      3  -0.266201D+01  0.264602D+00  0.308242D+00 -0.128671D+01 -0.221851D+01
               161           162           163           164           165 
      1   0.507958D+00 -0.221851D+01 -0.139115D+02 -0.285584D+01 -0.354575D+01
      2   0.973345D+00 -0.100032D+01 -0.285584D+01 -0.338324D+00  0.545982D-01
      3  -0.100032D+01  0.128158D+01 -0.354575D+01  0.545982D-01 -0.135141D+01
               166           167           168           169           170 
      1  -0.700119D+01 -0.861054D+00 -0.110532D+01  0.147371D+01  0.312091D+00
      2  -0.861054D+00 -0.850197D+00 -0.167973D+01  0.312091D+00 -0.306719D+00
      3  -0.110532D+01 -0.167973D+01 -0.209876D+01 -0.654133D+00 -0.106295D+01
               171           172           173           174           175 
      1  -0.654133D+00  0.113140D+02  0.235453D+01  0.157830D+01  0.785898D+01
      2  -0.106295D+01  0.235453D+01  0.648236D+00  0.402330D+00  0.870051D+00
      3  -0.718592D+01  0.157830D+01  0.402330D+00  0.301126D+01  0.139610D+01
               176           177           178           179           180 
      1   0.870051D+00  0.139610D+01  0.490217D+01  0.488498D+00  0.198265D+01
      2   0.384899D+00 -0.530814D+00  0.488498D+00 -0.915109D+00  0.522086D+00
      3  -0.530814D+00  0.155425D+01  0.198265D+01  0.522086D+00 -0.119512D+01
               181           182           183           184           185 
      1   0.107172D+02 -0.135985D+01 -0.808407D-01 -0.905644D+01  0.203028D+01
      2  -0.135985D+01  0.109681D+02 -0.200685D+01  0.203028D+01  0.272849D+01
      3  -0.808407D-01 -0.200685D+01  0.194344D+01  0.928606D+00 -0.159000D+01
               186           187           188           189           190 
      1   0.928606D+00  0.148235D+01  0.310000D+00  0.449486D+01  0.316669D+02
      2  -0.159000D+01  0.310000D+00 -0.264698D+01 -0.326438D+01 -0.542492D+01
      3  -0.103974D+01  0.449486D+01 -0.326438D+01  0.794240D+00 -0.312109D+00
               191           192           193           194           195 
      1  -0.542492D+01 -0.312109D+00 -0.211666D+02  0.254042D+01  0.198542D+01
      2   0.566802D+01 -0.322706D+00  0.254042D+01 -0.140419D+02  0.205267D+01
      3  -0.322706D+00  0.271656D+01  0.198542D+01  0.205267D+01 -0.140704D+01
               196           197           198           199           200 
      1   0.257369D+01  0.994624D+00  0.631136D+01 -0.380524D+02  0.917054D+01
      2   0.994624D+00  0.153678D+01 -0.209093D+01  0.917054D+01 -0.844528D+01
      3   0.631136D+01 -0.209093D+01 -0.134882D+00  0.605230D+00  0.135230D+01
               201           202           203           204           205 
      1   0.605230D+00  0.253231D+02 -0.333396D+01 -0.691855D+00 -0.186363D+01
      2   0.135230D+01 -0.333396D+01  0.716994D+01 -0.694017D-01  0.339953D+00
      3  -0.934529D-01 -0.691855D+00 -0.694017D-01  0.212070D+01  0.591188D+00
               206           207           208           209           210 
      1   0.339953D+00  0.591188D+00 -0.449447D+01 -0.410748D-01  0.305458D+00
      2   0.647480D+00  0.350686D+01 -0.410748D-01 -0.242224D+01  0.415684D+00
      3   0.350686D+01 -0.184505D+01  0.305458D+00  0.415684D+00 -0.591005D-01
               211           212           213           214           215 
      1   0.112643D+01  0.197783D+01 -0.260408D+00  0.202352D+00 -0.322884D+00
      2   0.197783D+01 -0.189677D+01  0.312361D+00 -0.322884D+00  0.319508D+00
      3  -0.260408D+00  0.312361D+00  0.104259D+01  0.470256D+00 -0.623812D+00
               216           217           218           219           220 
      1   0.470256D+00 -0.313385D+00  0.227998D+01 -0.397542D+00  0.211838D+01
      2  -0.623812D+00  0.227998D+01  0.243047D+01 -0.659335D+00 -0.182461D+01
      3  -0.436532D-01 -0.397542D+00 -0.659335D+00  0.142734D+01 -0.565464D+00
               221           222           223           224           225 
      1  -0.182461D+01 -0.565464D+00 -0.620497D+00 -0.447472D+00 -0.164564D+01
      2   0.312095D+00 -0.177078D+01 -0.447472D+00 -0.169472D+01 -0.348904D+01
      3  -0.177078D+01 -0.543038D+01 -0.164564D+01 -0.348904D+01  0.257802D+01
               226           227           228           229           230 
      1  -0.120745D+01 -0.179975D+01  0.410121D+00 -0.585203D+00 -0.196528D+01
      2  -0.179975D+01 -0.329775D+01  0.660313D+00 -0.196528D+01 -0.882630D+01
      3   0.410121D+00  0.660313D+00 -0.443809D+00  0.387311D+00  0.157776D+01
               231           232           233           234           235 
      1   0.387311D+00  0.229686D+00  0.494001D+00  0.861749D-01  0.492706D+01
      2   0.157776D+01  0.494001D+00  0.172497D+01 -0.598255D+00 -0.397512D+01
      3  -0.110195D+01  0.861749D-01 -0.598255D+00  0.317172D+00  0.408793D+00
               236           237           238           239           240 
      1  -0.397512D+01  0.408793D+00 -0.462763D+01  0.547619D+01 -0.804124D+00
      2   0.410369D+01 -0.418439D+00  0.547619D+01 -0.831732D+01  0.957264D+00
      3  -0.418439D+00  0.520762D+00 -0.804124D+00  0.957264D+00 -0.944858D+00
               241           242           243           244           245 
      1   0.482433D+00 -0.779634D+00 -0.159904D+00  0.304320D+01  0.252499D+01
      2  -0.779634D+00  0.111825D+01 -0.417649D+00  0.252499D+01  0.144914D+01
      3  -0.159904D+00 -0.417649D+00  0.278310D+00 -0.645540D+00 -0.391794D+00
               246           247           248           249           250 
      1  -0.645540D+00  0.394708D+01  0.313214D+01 -0.777617D+00 -0.913665D+00
      2  -0.391794D+00  0.313214D+01  0.517643D+01 -0.105564D+01 -0.735392D+00
      3   0.298619D+00 -0.777617D+00 -0.105564D+01  0.767682D+00  0.223346D+00
               251           252           253           254           255 
      1  -0.735392D+00  0.223346D+00 -0.126192D+01 -0.449547D+00 -0.448584D+00
      2  -0.106497D+01  0.157888D+00 -0.449547D+00 -0.228495D+00  0.115876D+00
      3   0.157888D+00 -0.133024D+00 -0.448584D+00  0.115876D+00 -0.109554D+01
               256           257           258           259           260 
      1   0.778421D+00  0.145489D+01 -0.102642D+01 -0.392521D+01 -0.143244D+01
      2   0.145489D+01  0.138847D+01 -0.152884D+01 -0.143244D+01 -0.136563D+01
      3  -0.102642D+01 -0.152884D+01  0.248057D+01  0.306206D+01  0.221877D+01
               261           262           263           264           265 
      1   0.306206D+01  0.158182D+02 -0.112057D+01 -0.692064D+00 -0.373129D+01
      2   0.221877D+01 -0.112057D+01  0.954658D+00  0.115550D+00  0.146202D+01
      3  -0.653851D+01 -0.692064D+00  0.115550D+00  0.110588D+01  0.265081D+00
               266           267           268           269           270 
      1   0.146202D+01  0.265081D+00 -0.214589D+00  0.112164D+00  0.155724D+01
      2  -0.795465D+00  0.659719D-01  0.112164D+00  0.151139D+00  0.153125D+00
      3   0.659719D-01 -0.139936D+00  0.155724D+01  0.153125D+00 -0.337295D+00
               271           272           273           274           275 
      1  -0.501741D+00  0.420913D-01  0.890022D+00  0.263167D+01  0.284065D+01
      2   0.420913D-01 -0.111146D-01  0.143757D-01  0.284065D+01  0.349007D+01
      3   0.890022D+00  0.143757D-01 -0.576227D+00  0.134701D+01  0.224933D+01
               276           277           278           279 
      1   0.134701D+01  0.417878D+01  0.199553D+01  0.200837D+01
      2   0.224933D+01  0.199553D+01  0.230964D+01  0.238441D+01
      3   0.250674D+01  0.200837D+01  0.238441D+01  0.328290D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1   0.324788D+01  0.220748D+01 -0.315645D+00  0.355882D+01 -0.191797D+01
      2   0.783895D+01  0.400120D+01 -0.206069D+00  0.789733D+01 -0.513759D+01
      3   0.454067D+01  0.241492D+02 -0.528657D+01  0.277297D+02 -0.243322D+02
                 6             7             8             9            10 
      1   0.160105D+00 -0.582550D+01  0.835575D+01 -0.148611D+01 -0.969628D+00
      2   0.202927D+01 -0.207840D+02  0.411268D+01 -0.879574D-02 -0.654737D+01
      3   0.280523D+01 -0.118927D+01  0.147914D+01  0.275340D+00  0.272855D+02
                11            12            13            14            15 
      1   0.296573D+01 -0.946220D+00 -0.788745D+00  0.792953D+00  0.340025D+00
      2   0.445064D+01 -0.514856D+01  0.127460D+01 -0.421649D+01  0.750296D+00
      3   0.175638D+02 -0.402915D+01  0.563656D+02 -0.331069D+02  0.289978D+01
                16            17            18            19            20 
      1  -0.626937D+01  0.872238D+01 -0.132209D+01 -0.380211D+01 -0.829905D+00
      2  -0.203290D+02  0.368251D+01  0.992333D+00 -0.943279D+01 -0.343792D+01
      3  -0.777362D+01  0.388190D+01  0.377175D+00 -0.600070D+00 -0.265284D+02
                21            22            23            24            25 
      1   0.332011D+00 -0.465325D+00  0.281113D+00 -0.133049D+01 -0.865010D+01
      2   0.399951D+00  0.243481D+01  0.210637D+01  0.113771D+01 -0.189097D+02
      3   0.555531D+01 -0.595987D+01  0.575306D+01 -0.223326D+01  0.663793D+01
                26            27            28            29            30 
      1   0.439856D+01 -0.112677D+01  0.670225D+00  0.172775D+01  0.484828D+00
      2   0.871846D+01 -0.756454D+00  0.763499D+01  0.206223D+01  0.950220D+00
      3  -0.209383D+01 -0.800271D+00 -0.263477D+02  0.132156D+02 -0.170540D+01
                31            32            33            34            35 
      1   0.576945D+01  0.366963D+01  0.113537D+01  0.382908D+01  0.135993D+02
      2   0.278845D+00  0.207097D+00  0.437171D+00 -0.137927D+02  0.809190D+00
      3   0.314019D+02 -0.256614D+01 -0.119509D+01 -0.191764D+01 -0.269031D+01
                36            37            38            39            40 
      1  -0.224110D+01  0.576386D-02 -0.362074D+00  0.444594D+01  0.133395D+01
      2   0.775780D+00 -0.383841D+01 -0.937414D+00  0.178159D+00 -0.346284D+01
      3  -0.236253D+01 -0.780385D+01 -0.250989D+01 -0.668237D-01  0.131585D+02
                41            42            43            44            45 
      1  -0.104066D+01 -0.278385D+01  0.174883D+02  0.119432D+01 -0.211096D+00
      2  -0.338676D+01 -0.174103D+01 -0.102537D+02 -0.668754D+01  0.252939D+01
      3  -0.720986D+01  0.256992D+00 -0.388920D+01  0.164123D+01 -0.598427D+01
                46            47            48            49            50 
      1  -0.802907D+00 -0.181958D+01 -0.472740D+01 -0.276287D+01  0.677307D+00
      2   0.412037D+01 -0.336796D+01  0.234414D+01 -0.590518D+01  0.545797D+01
      3   0.222025D+02 -0.227028D+02  0.346671D+01 -0.985268D+01  0.245566D+02
                51            52            53            54            55 
      1  -0.212000D+01 -0.117468D+02 -0.250001D+01  0.309677D+01  0.168393D+01
      2  -0.909898D+00 -0.155737D+02  0.151003D+01  0.121984D+01  0.551334D+01
      3  -0.292438D+01  0.389775D+01 -0.246725D+01  0.534602D+01  0.325245D+02
                56            57            58            59            60 
      1  -0.367158D+01 -0.420360D+01 -0.243552D+01  0.135116D+01 -0.162170D+01
      2  -0.389055D+01 -0.297273D+01 -0.560701D+01  0.397943D+01 -0.189960D+01
      3  -0.125653D+02  0.226124D+01 -0.730087D+01  0.256353D+02 -0.163802D+01
                61            62            63            64            65 
      1  -0.117602D+02 -0.230045D+01  0.210586D+01 -0.239778D+00 -0.507336D+00
      2  -0.212855D+02 -0.202466D+01  0.516405D+01  0.111177D+01  0.796617D+00
      3   0.502689D+01 -0.109536D+01  0.128750D+02  0.184125D+01 -0.281008D-01
                66            67            68            69            70 
      1  -0.167142D+01 -0.725050D+00 -0.149685D+01 -0.274203D+01 -0.595216D+00
      2   0.495652D+00  0.112832D+01 -0.296554D-01  0.182176D+01 -0.241095D+01
      3   0.242706D-02  0.322691D+01 -0.513378D+01  0.846496D+00 -0.197998D+00
                71            72            73            74            75 
      1   0.220499D+01  0.386745D+00 -0.298794D+00  0.195733D+00  0.210134D+01
      2  -0.897079D+00  0.120008D-01 -0.745422D+00 -0.154224D+00  0.131138D+01
      3   0.857029D+00  0.580471D+00 -0.834830D+01  0.158302D+01  0.310796D-02
                76            77            78            79            80 
      1  -0.112750D+01  0.835713D+00 -0.394614D+01 -0.295261D+01  0.156059D+01
      2  -0.431929D+00  0.702954D+00 -0.229271D+01 -0.157450D+01 -0.150045D+00
      3   0.396229D+01  0.148279D+01  0.386249D+00  0.376362D+00 -0.416232D+00
                81            82            83            84            85 
      1   0.488854D+00  0.812755D+00  0.553464D+00 -0.200910D+01  0.667323D+00
      2   0.526880D+00  0.989613D+00  0.496840D+00  0.100531D+01  0.674731D+00
      3   0.128249D+01  0.698359D+01  0.334363D+01 -0.122283D+01  0.527333D+01
                86            87            88            89            90 
      1   0.140386D+01 -0.449492D+01  0.102918D+01  0.187441D+01  0.453597D+00
      2   0.739353D+00  0.138841D+01 -0.924568D+00  0.636377D+00 -0.659371D+00
      3   0.395665D+01 -0.120285D+01 -0.110806D+01 -0.142600D+01 -0.518133D+00
                91            92            93            94            95 
      1   0.290042D+01  0.939834D+00 -0.172975D+01  0.562285D+01 -0.752320D+00
      2  -0.785084D+01 -0.209347D+01 -0.655099D+01 -0.287073D+01 -0.866688D+01
      3   0.152278D+02 -0.161597D+01  0.283139D+01  0.227101D+02 -0.197563D+02
                96            97            98            99           100 
      1  -0.230720D+01 -0.284630D+01  0.537827D+01  0.128124D+01  0.182811D+01
      2  -0.262918D+01 -0.360738D+02  0.199519D+00  0.362192D+01 -0.120894D+02
      3   0.798999D+01  0.124507D+01  0.113250D+02  0.842158D+01  0.167657D+01
               101           102           103           104           105 
      1  -0.626010D+01  0.409567D+00 -0.258983D+01  0.422165D+01 -0.114725D+02
      2   0.205324D+01  0.174935D+02 -0.523101D+00  0.188613D+02  0.648278D+01
      3  -0.140637D+02 -0.142860D+01 -0.926069D+01  0.864516D+01 -0.157711D+02
               106           107           108           109           110 
      1   0.317568D+01 -0.579317D+01 -0.529170D+01 -0.534390D+01  0.941956D+00
      2   0.176777D+02  0.271016D+01 -0.424633D+01  0.136437D+02  0.446131D+01
      3   0.572738D+01 -0.148327D+02 -0.761096D+01 -0.565995D+01  0.106136D+02
               111           112           113           114           115 
      1   0.979636D+01 -0.115996D+02 -0.666496D+01 -0.833267D+01  0.946590D+01
      2   0.245816D+01  0.592174D+01  0.405440D+01 -0.101025D+02  0.862312D+01
      3  -0.668877D+01  0.909478D+01  0.177770D+02 -0.193663D+01 -0.183303D+02
               116           117           118           119           120 
      1   0.920805D-02  0.585699D+01  0.124594D+01 -0.109727D+01  0.101750D+01
      2  -0.207141D+01  0.207720D+01  0.278834D+01 -0.977676D+00  0.501008D+01
      3  -0.626023D+01 -0.516262D+01  0.929779D+01 -0.638137D+01 -0.239947D+00
               121           122           123           124           125 
      1  -0.132263D+01  0.248996D+01 -0.300698D+01  0.101432D+01 -0.429545D+00
      2  -0.175308D+01  0.464154D+01 -0.507910D+01  0.289686D+01 -0.356284D+01
      3  -0.100577D+01  0.212011D+02 -0.371471D+01 -0.105522D+01 -0.530093D+01
               126           127           128           129           130 
      1   0.547322D+00 -0.264770D+01  0.268885D+01 -0.477696D+00  0.973620D+00
      2   0.175405D+01 -0.299771D+01  0.291898D+01 -0.450768D+01  0.267062D+01
      3   0.234141D+01 -0.500550D+01  0.387408D+01 -0.115432D+01  0.333582D+01
               131           132           133           134           135 
      1  -0.108168D+02  0.346949D+01  0.120691D+00  0.503231D+01 -0.272804D+01
      2  -0.100760D+02  0.906606D+01 -0.188879D+01  0.450103D+01 -0.724636D+01
      3  -0.169692D+02  0.919688D+01  0.620164D+00  0.580737D+01 -0.504031D+01
               136           137           138           139           140 
      1  -0.161588D+01 -0.254850D+01  0.845721D+00 -0.241296D+01 -0.780152D+00
      2   0.112822D+02  0.677978D-01  0.739046D+01  0.182242D+00 -0.776593D+00
      3  -0.546933D+01 -0.579942D+01  0.722856D+00 -0.379797D+01 -0.739500D+00
               141           142           143           144           145 
      1   0.334961D+00 -0.116984D+00  0.131186D+01  0.605367D-01  0.184921D+01
      2  -0.174152D+00  0.158872D+01  0.390180D+00  0.985355D+00 -0.490096D+01
      3   0.243387D+01 -0.864750D+00  0.275580D+01 -0.479373D+00  0.348928D+01
               146           147           148           149           150 
      1   0.302572D+01  0.213370D+00  0.182893D+01  0.584154D+01  0.240330D+01
      2  -0.470479D+01 -0.838675D+01 -0.278549D+01 -0.119376D+02 -0.133439D+02
      3   0.445854D+01  0.318006D+01  0.358175D+01  0.110359D+02  0.101626D+02
               151           152           153           154           155 
      1  -0.226179D+00  0.498762D+01  0.250150D+01  0.461936D+01  0.915435D+00
      2  -0.423684D+01 -0.956245D+01 -0.170969D+02 -0.108996D+02 -0.108343D+01
      3  -0.115142D+00  0.765273D+01  0.884794D+01 -0.888375D+01 -0.220699D+02
               156           157           158           159           160 
      1  -0.592978D+01  0.790222D+01  0.438759D+01 -0.338541D+01 -0.334393D+01
      2   0.206416D+02 -0.343114D+00 -0.450754D+01  0.116852D+02  0.529964D+01
      3  -0.510708D+00 -0.185937D+02 -0.237118D+02  0.385922D+00  0.399878D+01
               161           162           163           164           165 
      1   0.146930D+01  0.137844D+01  0.644845D+01  0.302143D+01 -0.302507D+01
      2   0.336943D+01 -0.827488D+01 -0.141482D+02 -0.523421D+01  0.309022D+01
      3   0.413435D+01 -0.266190D+01 -0.937321D+01 -0.383157D+01  0.584667D+00
               166           167           168           169           170 
      1   0.863674D+01  0.451614D+01  0.221969D+01 -0.138539D+01  0.716781D+01
      2  -0.961427D+01  0.482297D+01  0.857532D+01 -0.242093D+01  0.352831D+01
      3  -0.102139D+01 -0.450502D+01 -0.912183D+01  0.654492D+01 -0.216695D+01
               171           172           173           174           175 
      1  -0.267004D+01 -0.783014D+01 -0.355679D+01  0.473961D+00 -0.967714D+01
      2   0.235286D+02  0.228753D+02  0.396750D+01 -0.769735D+01  0.919903D+01
      3  -0.318753D+01  0.289189D+01  0.241842D+01  0.230709D+01  0.895677D+01
               176           177           178           179           180 
      1  -0.301545D+01 -0.189971D+01  0.627136D-01 -0.171170D+00 -0.723902D+00
      2   0.378703D+01 -0.436520D+01 -0.296778D+01 -0.102867D+01  0.576047D+01
      3   0.871379D+00  0.634396D+00  0.197768D+01  0.773194D+00  0.746193D+00
               181           182           183           184           185 
      1  -0.718608D+00  0.213441D+01  0.439892D+01  0.269025D+01 -0.107800D+01
      2  -0.698189D+01 -0.191622D+01  0.597549D+01 -0.113177D+01 -0.789219D+01
      3  -0.308594D+02 -0.129351D+02  0.297965D+01 -0.121346D+02 -0.277787D+02
               186           187           188           189           190 
      1  -0.234673D+01  0.159696D+02  0.402089D+01 -0.254791D+01 -0.100229D+01
      2  -0.860684D+00 -0.229701D+01 -0.109023D+02  0.106062D+01 -0.402444D+01
      3   0.616732D+01  0.354237D+01  0.769178D+01 -0.297253D+01  0.110910D+02
               191           192           193           194           195 
      1   0.331526D+01 -0.443840D+00  0.338284D+01  0.216623D+01  0.275359D+01
      2   0.412773D+01 -0.216710D+01  0.137435D+02  0.156057D+01 -0.272714D+01
      3   0.213470D+02 -0.404262D+01  0.532286D+02  0.179164D+02 -0.571169D+01
               196           197           198           199           200 
      1  -0.421429D+01  0.147542D+02 -0.312920D+01  0.235704D+00 -0.205708D+01
      2  -0.166010D+01 -0.503437D+01  0.115093D+01  0.270575D+01 -0.208353D+01
      3  -0.101176D+02 -0.402903D+01  0.603022D+01 -0.209477D+02 -0.121460D+02
               201           202           203           204           205 
      1   0.270430D+00 -0.203572D+01  0.134542D+01 -0.305928D+01 -0.393481D+01
      2   0.419815D+01 -0.862424D+01  0.436223D+01  0.344052D+01 -0.172477D+02
      3   0.237454D+01 -0.400291D+01  0.207708D+00 -0.165208D+01  0.541787D+01
               206           207           208           209           210 
      1   0.393651D+01  0.252242D+00  0.105322D+01 -0.310711D+01  0.725256D+00
      2   0.153934D+02 -0.432183D+01  0.312514D+01 -0.528582D+01  0.130437D+02
      3  -0.371547D+01 -0.673574D+01  0.940035D+01 -0.407853D+02  0.479557D+01
               211           212           213           214           215 
      1   0.258188D+00 -0.938001D+00 -0.575334D+01  0.252402D+01 -0.146989D+01
      2  -0.121434D+01  0.231120D+01  0.637752D+01 -0.562412D+01 -0.380340D+01
      3  -0.241385D+01  0.116441D+02 -0.258225D+01  0.746269D+00  0.179434D+01
               216           217           218           219           220 
      1   0.117885D+01 -0.142808D+01  0.485024D+00 -0.120025D+01  0.304897D+01
      2  -0.744576D+00 -0.683571D+01 -0.126325D+01  0.786763D+01 -0.272975D+01
      3   0.159321D+01 -0.364052D+02 -0.227522D+01  0.376624D+01  0.109316D+02
               221           222           223           224           225 
      1   0.374055D+01  0.545884D+01  0.124384D+02  0.696887D+01 -0.171919D+01
      2  -0.677680D+01 -0.328754D+02 -0.871304D+01 -0.212475D+02  0.160515D+02
      3   0.200707D+02  0.707158D+01  0.363076D+01  0.568202D+01  0.271401D+02
               226           227           228           229           230 
      1   0.215515D+00 -0.300446D+00 -0.193534D+01  0.937467D-02 -0.813242D+00
      2   0.191483D+01  0.185832D+01 -0.532587D-01  0.138417D+01  0.372435D+01
      3   0.904330D+01  0.804446D+01 -0.206996D+01  0.666935D+01  0.184524D+02
               231           232           233           234           235 
      1  -0.406887D+01  0.124855D+01  0.199634D+01  0.362466D+00 -0.787573D+00
      2  -0.593131D+00 -0.149273D+00 -0.117367D+01  0.139106D-01 -0.864907D+00
      3  -0.373612D+01 -0.207187D+01 -0.394748D+01  0.285994D+00 -0.116923D+00
               236           237           238           239           240 
      1   0.839744D+00  0.212864D+01 -0.163930D+00 -0.903045D+00 -0.363641D+01
      2   0.306589D-01  0.247763D+01 -0.100291D+01  0.116601D+01 -0.386489D+01
      3  -0.566576D+01  0.573204D+00 -0.610035D+01  0.165886D+02 -0.136741D+01
               241           242           243           244           245 
      1  -0.273647D+01  0.114574D+01  0.577831D+00  0.294003D+00 -0.520166D-01
      2  -0.208290D+01 -0.133261D+01  0.126371D+01 -0.653997D+00 -0.842498D+00
      3   0.188037D+01 -0.214082D+01  0.197486D+01 -0.438025D+00 -0.266026D+01
               246           247           248           249           250 
      1  -0.109551D+01  0.203197D+00 -0.281533D+00 -0.264435D+01 -0.366393D+00
      2   0.103079D+01 -0.999770D+00 -0.279156D+01  0.281582D+01 -0.112581D+01
      3   0.447560D+00 -0.117866D+01 -0.132773D+02  0.234483D+01  0.558668D+00
               251           252           253           254           255 
      1   0.132621D+01  0.365970D+00 -0.441382D+00  0.618726D+00  0.148647D+01
      2  -0.786371D+00 -0.123393D+00 -0.548599D+01  0.958531D+00 -0.566152D+01
      3   0.280489D+01  0.496603D-01  0.125296D+01  0.327319D+01 -0.257405D+01
               256           257           258           259           260 
      1  -0.219363D+00 -0.199302D+00 -0.207247D+01 -0.268875D+01  0.137807D+01
      2  -0.443707D+01 -0.836653D+01  0.141439D+02  0.102512D+02  0.129266D+02
      3  -0.539821D+01 -0.127205D+02  0.103629D+02  0.564005D+01  0.111823D+02
               261           262           263           264           265 
      1   0.529495D+01  0.707770D+00 -0.563238D+00 -0.344557D+00 -0.585123D+00
      2  -0.357965D+02  0.117562D+01  0.626102D-01  0.863998D+01  0.434496D+00
      3  -0.175692D+02  0.155777D+02 -0.994480D+01 -0.907992D+00 -0.834041D+01
               266           267           268           269           270 
      1   0.127090D+00 -0.762783D+00 -0.133063D+01  0.944712D-01  0.177175D+00
      2   0.837531D+00 -0.104527D+01  0.727136D+01  0.888893D+00 -0.164067D+01
      3   0.563766D+01 -0.495088D+00 -0.926197D+00 -0.777305D+00 -0.997153D+00
               271           272           273           274           275 
      1   0.110532D+00  0.156476D+00  0.924868D+00 -0.183803D+01 -0.289771D+01
      2   0.644028D+01  0.706897D+00 -0.247177D+01  0.621215D+01  0.112399D+02
      3  -0.177032D+01  0.192028D+01  0.330471D+00 -0.116757D+02 -0.259228D+02
               276           277           278           279 
      1  -0.466598D+01 -0.367386D+01 -0.151974D+01 -0.542457D+01
      2   0.143521D+02  0.712835D+01  0.131852D+02  0.175638D+02
      3  -0.137989D+02 -0.791244D+01 -0.161031D+02 -0.160852D+02
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.761695D+02  0.367448D+02 -0.279563D+01 -0.706559D+02  0.447208D+01
      2   0.369437D+02 -0.234615D+02  0.211127D+01  0.365056D+02  0.467873D+01
      3   0.392259D+02 -0.132833D+02  0.684366D+00  0.341503D+02 -0.915081D+01
      4   0.180146D+02  0.922352D+01 -0.227167D+01  0.114228D+02 -0.196918D+02
      5  -0.583781D+01 -0.278261D+01  0.877648D+00 -0.547338D+01  0.629938D+01
      6   0.400407D+01  0.252172D+00  0.112907D+01  0.386033D+01 -0.504972D+01
                 6             7             8             9            10 
      1   0.208621D+01  0.179069D+02 -0.493123D+01 -0.972590D+01  0.115911D+03
      2  -0.376449D+01 -0.774142D+01  0.156553D+01 -0.121566D+01 -0.539917D+02
      3   0.167828D+01 -0.101654D+02  0.336570D+01  0.109416D+02 -0.619188D+02
      4   0.343873D+01 -0.315453D+01  0.303374D+01 -0.442230D+00  0.421274D+01
      5   0.252616D+01  0.899068D+00 -0.585772D+00  0.174399D+00  0.277182D+00
      6   0.375216D+00  0.192814D+01  0.341652D+01  0.145403D+01 -0.776396D+01
                11            12            13            14            15 
      1  -0.677980D+01 -0.736312D+01  0.532044D+02 -0.283855D+02  0.130973D+01
      2   0.136746D+01  0.320592D+01 -0.176510D+02  0.197167D+02 -0.354835D+01
      3   0.541234D+01  0.415720D+01 -0.355534D+02  0.866885D+01  0.223862D+01
      4   0.133919D+02 -0.458376D+01 -0.259643D+02  0.172513D+02 -0.113462D+01
      5  -0.657809D+01 -0.849834D+01  0.894659D+01 -0.277787D+01 -0.108852D-01
      6   0.332464D+01  0.864820D+00 -0.423989D+01 -0.272685D+00 -0.679590D+00
                16            17            18            19            20 
      1  -0.176533D+02  0.503766D+01 -0.429672D+01  0.446168D+02 -0.430808D+02
      2   0.721890D+01 -0.356271D+01 -0.327041D+01 -0.199562D+02  0.306307D+02
      3   0.104344D+02 -0.147495D+01  0.756713D+01 -0.246606D+02  0.124500D+02
      4   0.572631D+01 -0.297563D+01  0.384055D+01 -0.224533D+02 -0.114369D+02
      5   0.155820D+01  0.309208D+01  0.102165D+01  0.846036D+01  0.339654D+01
      6   0.481217D+01  0.313094D+01  0.186445D+01 -0.401113D+01  0.392886D+00
                21            22            23            24            25 
      1   0.448116D+01  0.353808D+01  0.336664D+02 -0.490684D+01 -0.468842D+01
      2  -0.348830D+01 -0.206275D+02 -0.323300D+02  0.618625D+01  0.758179D+01
      3  -0.992862D+00  0.170894D+02 -0.133632D+01 -0.127941D+01 -0.289338D+01
      4   0.239640D+01  0.161559D+02 -0.271539D+01  0.343283D+01 -0.201362D+01
      5  -0.377996D+01 -0.624439D+01  0.372218D+01  0.796356D+01  0.454760D+01
      6   0.751684D+00  0.106656D+02  0.536341D+01  0.160054D+01  0.295889D+01
                26            27            28            29            30 
      1  -0.205091D+01 -0.778017D+01  0.102492D+02  0.262020D+00  0.382472D+01
      2   0.572071D+01 -0.655842D+01 -0.275747D+02 -0.283557D+01 -0.144802D+01
      3  -0.366980D+01  0.143386D+02  0.173254D+02  0.257355D+01 -0.237670D+01
      4   0.524366D+01  0.430722D+01  0.155082D+01  0.141538D+02  0.894681D+00
      5   0.922595D+01 -0.238756D+01 -0.126201D+02  0.259546D+01  0.106905D+02
      6   0.430142D+01 -0.533562D+00  0.126164D+02 -0.175129D+01 -0.246288D+01
                31            32            33            34            35 
      1   0.213674D+02 -0.626141D+02  0.720789D+01 -0.466828D+01  0.101078D+02
      2  -0.773560D+01  0.577728D+02 -0.112358D+02  0.132958D+00 -0.109186D+02
      3  -0.136319D+02  0.484125D+01  0.402794D+01  0.453532D+01  0.810835D+00
      4  -0.372146D+02 -0.109130D+02  0.417171D+01  0.147125D+02  0.319597D+01
      5   0.110259D+02  0.471121D+01 -0.138777D+01  0.338644D+02 -0.610525D+01
      6  -0.190978D+01 -0.515624D+01 -0.186615D+01 -0.704732D+01  0.595440D+01
                36            37            38            39            40 
      1  -0.254009D+00 -0.529482D+01  0.660345D+02 -0.128594D+02 -0.210686D+02
      2  -0.868193D+01  0.370283D+00 -0.507651D+02  0.779234D+01  0.243543D+02
      3   0.893594D+01  0.492454D+01 -0.152694D+02  0.506709D+01 -0.328568D+01
      4  -0.529040D+00  0.201955D+02 -0.147662D+02 -0.137308D+00  0.163157D+02
      5  -0.339001D+00 -0.330363D+01 -0.335123D+01  0.129827D+01  0.366784D+01
      6   0.546800D+01 -0.394418D+01  0.375601D+01 -0.871762D+01 -0.113317D+02
                41            42            43            44            45 
      1   0.235958D+02 -0.762663D+01  0.658091D+01 -0.135201D+02 -0.132519D+02
      2  -0.278755D+02  0.727257D+01 -0.105174D+02  0.150870D+02  0.378734D+01
      3   0.427975D+01  0.354063D+00  0.393651D+01 -0.156695D+01  0.946453D+01
      4   0.169294D+02 -0.757257D+01  0.603057D+00 -0.551070D+01 -0.714407D+01
      5  -0.878080D+01 -0.728411D+01  0.191320D+02 -0.834244D+01  0.421730D+01
      6   0.861539D+01  0.513949D+01 -0.190684D+02  0.169394D+02  0.291467D+00
                46            47            48            49            50 
      1   0.157437D+01 -0.513721D+02  0.768191D+01  0.297332D+02  0.379509D+01
      2  -0.247346D+01  0.402466D+02 -0.328871D+01 -0.257433D+02 -0.996708D+01
      3   0.899093D+00  0.111255D+02 -0.439320D+01 -0.398986D+01  0.617199D+01
      4  -0.152486D+02 -0.730325D+01  0.383634D+01  0.943998D+01 -0.120157D+02
      5   0.487858D+01  0.574937D+01  0.593886D+00 -0.234918D+01  0.254114D+01
      6   0.406978D+01  0.775224D+00  0.791666D+01  0.342148D+01  0.102106D+02
                51            52            53            54            55 
      1  -0.693757D+01 -0.540364D+01 -0.167147D+01 -0.214252D+02 -0.213836D+02
      2   0.772559D+01  0.689941D+01  0.871913D+01  0.959421D+01  0.796177D+01
      3  -0.788015D+00 -0.149577D+01 -0.704766D+01  0.118310D+02  0.134218D+02
      4   0.370943D+01  0.175322D+01  0.665262D+01  0.673655D+01  0.562889D+01
      5   0.840646D+00  0.461340D+01  0.308333D+01 -0.453944D+00 -0.265740D+01
      6   0.384868D+01  0.454078D+01  0.211353D+02 -0.528179D+01  0.310989D+01
                56            57            58            59            60 
      1  -0.357182D+02  0.586298D+01  0.104167D+02  0.152916D+02 -0.859487D+01
      2   0.313778D+02 -0.207590D+01 -0.119654D+02 -0.160408D+02  0.809926D+01
      3   0.434036D+01 -0.378707D+01  0.154869D+01  0.749266D+00  0.495612D+00
      4  -0.475060D+02  0.753899D+01  0.114529D+02 -0.653256D+01 -0.235016D+00
      5   0.107979D+02 -0.805838D+01 -0.246710D+01 -0.157321D+01 -0.878590D+00
      6  -0.265075D+01  0.828250D+01  0.375532D+01  0.941301D+01  0.269366D+01
                61            62            63            64            65 
      1  -0.198139D+01 -0.558901D+01 -0.269724D+02  0.327679D+01 -0.112797D+01
      2   0.532007D+01  0.116562D+02  0.984169D+01 -0.437249D+00  0.235691D+01
      3  -0.333868D+01 -0.606723D+01  0.171307D+02 -0.283954D+01 -0.122894D+01
      4  -0.278436D+01  0.354777D+01 -0.521199D+01  0.975129D+01  0.101137D+02
      5  -0.236170D+01 -0.987270D+01  0.621576D+01 -0.292939D+01 -0.222473D+01
      6   0.578919D+01  0.190224D+02 -0.635087D+01 -0.185153D+01 -0.152157D+01
                66            67            68            69            70 
      1   0.267408D+00 -0.407922D+01 -0.144994D+02  0.333587D+01  0.797523D-02
      2   0.241181D+00  0.628054D+01  0.172398D+02 -0.161999D+01  0.125014D+00
      3  -0.508589D+00 -0.220132D+01 -0.274043D+01 -0.171588D+01 -0.132989D+00
      4  -0.171604D+01  0.137352D+02  0.182756D+02 -0.333458D+01 -0.293269D+01
      5   0.282709D+01 -0.351710D+01 -0.351343D+01  0.351331D+01  0.150215D+01
      6   0.147153D+01 -0.318426D+01 -0.609224D+01  0.492043D+01  0.206919D+01
                71            72            73            74            75 
      1   0.200814D+01 -0.268090D+01 -0.108783D+01  0.707882D+01 -0.875969D+00
      2  -0.187502D+01  0.244306D+01  0.105613D+02 -0.162137D+02  0.147586D+01
      3  -0.133120D+00  0.237841D+00 -0.947349D+01  0.913491D+01 -0.599894D+00
      4  -0.352448D+01  0.228949D+01 -0.224244D+02  0.224301D+02 -0.238757D+01
      5   0.714619D+00 -0.135990D+01  0.188502D+01 -0.244525D+01  0.290446D+01
      6   0.292810D+01 -0.201952D+01 -0.113303D+01  0.154833D+01 -0.267977D+01
                76            77            78            79            80 
      1   0.124497D+02 -0.298379D+02  0.354691D+01 -0.238019D+01  0.441103D+01
      2  -0.236834D+02  0.479342D+02 -0.443456D+01  0.422500D+01 -0.636569D+01
      3   0.112337D+02 -0.180963D+02  0.887652D+00 -0.184481D+01  0.195466D+01
      4   0.244889D+02 -0.338789D+02  0.375037D+01 -0.326238D+01  0.415276D+01
      5  -0.327756D+01  0.422805D+01 -0.346602D+01  0.268939D+00 -0.206282D+01
      6   0.374464D+01 -0.533201D+01  0.655191D+01  0.116069D+01  0.319428D+01
                81            82            83            84            85 
      1  -0.158502D+01 -0.622240D+01 -0.105774D+02  0.243748D+01 -0.968523D+01
      2   0.270800D+01  0.102504D+02  0.171383D+02 -0.275085D+01  0.139132D+02
      3  -0.112298D+01 -0.402798D+01 -0.656092D+01  0.313366D+00 -0.422793D+01
      4  -0.274499D+01  0.115979D+02  0.194722D+02 -0.340579D+01  0.121972D+02
      5   0.108930D+01 -0.133901D+01 -0.196657D+01  0.288119D+01 -0.138818D+01
      6  -0.190229D+01 -0.255164D+01 -0.394116D+01  0.334506D+01 -0.289029D+01
                86            87            88            89            90 
      1  -0.415968D+02  0.788021D+01  0.187442D+01  0.841010D+01 -0.262629D+01
      2   0.584488D+02 -0.884786D+01 -0.283108D+01 -0.104422D+02  0.307620D+01
      3  -0.168520D+02  0.967649D+00  0.956660D+00  0.203209D+01 -0.449912D+00
      4   0.274772D+02 -0.451570D+01 -0.320514D+01 -0.508738D+01  0.323012D+01
      5  -0.199190D+01  0.215149D+01  0.816542D+00  0.285957D+01 -0.143066D+01
      6  -0.109819D+02  0.852175D+01  0.981455D+00  0.521330D+01 -0.289279D+01
                91            92            93            94            95 
      1  -0.770304D+01  0.181260D+01 -0.145638D+02 -0.663108D+01 -0.154224D+01
      2   0.139491D+02  0.235653D+01  0.123910D+01  0.129253D+02 -0.115331D+02
      3  -0.624607D+01 -0.416913D+01  0.133247D+02 -0.629423D+01  0.130753D+02
      4  -0.576887D+01 -0.144563D+02 -0.383742D+01 -0.165371D+02  0.379004D+02
      5  -0.971264D+00 -0.465245D+01 -0.214245D+02  0.164686D+01 -0.132652D+02
      6  -0.541305D+01  0.171070D+01  0.110590D+01 -0.430802D+01  0.335724D+01
                96            97            98            99           100 
      1  -0.216973D+01 -0.265369D+01 -0.420121D+01 -0.213734D+02 -0.789158D+02
      2   0.148271D+01 -0.126378D+02  0.907226D+01  0.204999D+02  0.448949D+02
      3   0.687019D+00  0.152915D+02 -0.487105D+01  0.873530D+00  0.340209D+02
      4  -0.152418D+02 -0.854897D+01 -0.168412D+02 -0.384074D+01  0.124506D+02
      5  -0.539559D+01 -0.647570D+02  0.205274D+01  0.160334D+02  0.427270D+02
      6   0.400201D+01  0.261153D+01 -0.624220D+00 -0.140000D+01 -0.421474D+01
               101           102           103           104           105 
      1   0.810894D+01  0.304984D+02  0.505771D+01  0.303616D+02  0.915166D+01
      2  -0.361700D+01 -0.854434D+01 -0.642214D+01 -0.509969D+01  0.268487D+00
      3  -0.449194D+01 -0.219541D+02  0.136443D+01 -0.252619D+02 -0.942015D+01
      4   0.178126D+02  0.125797D+01  0.166854D+02 -0.148225D+02  0.240592D+02
      5   0.829604D+00  0.103409D+02 -0.140922D+00  0.161360D+02  0.771183D+01
      6  -0.114222D+02 -0.325375D+01 -0.596776D+01  0.374008D+01 -0.199304D+02
               106           107           108           109           110 
      1   0.364981D+01  0.847081D+01  0.208565D+02 -0.802042D+02 -0.258553D+02
      2   0.172173D+02 -0.344585D+01 -0.224418D+02  0.306097D+02  0.468574D+01
      3  -0.208671D+02 -0.502497D+01  0.158529D+01  0.495945D+02  0.211696D+02
      4   0.228156D+01  0.196113D+02  0.442086D+01 -0.439686D+02 -0.257381D+02
      5   0.416690D+02  0.131760D+01 -0.290806D+02  0.189733D+01 -0.195185D+01
      6  -0.385454D+01 -0.141452D+02 -0.748137D+01 -0.909935D+00  0.212697D+01
               111           112           113           114           115 
      1   0.179938D+01 -0.348873D+02 -0.153733D+02  0.895102D+01  0.405900D+02
      2  -0.234875D+01  0.753834D+01  0.567122D+01 -0.638995D+00 -0.196257D+02
      3   0.549378D+00  0.273490D+02  0.970209D+01 -0.831203D+01 -0.209643D+02
      4   0.854086D+00 -0.117331D+02 -0.235159D+02  0.849233D+01  0.187510D+02
      5  -0.194186D+01 -0.324658D+01  0.606066D+01 -0.545072D+01  0.268021D+02
      6  -0.407821D+01  0.347119D+01 -0.373108D+01  0.176786D+00  0.485272D+01
               116           117           118           119           120 
      1   0.757821D+01  0.259668D+02  0.737753D+01 -0.949008D+01  0.490571D+01
      2  -0.305176D+01 -0.380283D+01  0.310564D+01  0.120395D+00 -0.125484D+01
      3  -0.452644D+01 -0.221640D+02 -0.104832D+02  0.936968D+01 -0.365087D+01
      4   0.151615D+02  0.617617D+01 -0.211418D+02  0.212021D+02 -0.920858D+00
      5   0.364565D+01  0.165478D+01  0.563427D+01 -0.519565D+00  0.100368D+02
      6  -0.112396D+01 -0.891047D+00 -0.158378D+01  0.645975D+00 -0.850685D+00
               121           122           123           124           125 
      1  -0.165727D+02 -0.207544D+01 -0.639615D+00  0.656068D+01  0.159831D+01
      2   0.260719D+01  0.199238D+02 -0.301374D+01 -0.226717D+01 -0.481981D+01
      3   0.139655D+02 -0.178483D+02  0.365335D+01 -0.429351D+01  0.322149D+01
      4   0.234055D+02 -0.497927D+02  0.772246D+01 -0.311732D+01  0.116898D+02
      5  -0.203933D+01  0.698797D+01 -0.103542D+02  0.120439D+02 -0.818495D+01
      6   0.639077D+00 -0.264174D+01  0.427061D+01 -0.262777D+01  0.631184D+01
               126           127           128           129           130 
      1   0.257512D+01  0.874627D+00  0.642854D+01 -0.887910D+01  0.986927D+01
      2  -0.642521D+00 -0.439792D+00 -0.283549D+01  0.138581D+00 -0.666227D+01
      3  -0.193260D+01 -0.434835D+00 -0.359304D+01  0.874052D+01 -0.320700D+01
      4  -0.878420D+01  0.360679D+01 -0.468457D+01  0.147952D+01  0.151834D+01
      5   0.343649D+01 -0.148420D+01 -0.100432D+01 -0.444407D+01 -0.945081D+01
      6  -0.249561D+01 -0.311279D+01  0.458733D+01 -0.168979D+01  0.177647D+00
               131           132           133           134           135 
      1  -0.159923D+02  0.873409D+01 -0.328865D+01  0.542115D+01 -0.116755D+02
      2   0.579721D+01  0.354912D+01  0.850407D+00  0.168237D+01 -0.131550D+01
      3   0.101950D+02 -0.122832D+02  0.243824D+01 -0.710352D+01  0.129910D+02
      4   0.286427D+02 -0.157944D+02 -0.103248D+01 -0.104792D+02  0.853575D+01
      5  -0.119014D+02  0.166958D+02  0.162680D+01  0.682876D+01 -0.908876D+01
      6  -0.195413D+02  0.134310D+02  0.628823D+00  0.106996D+02 -0.710311D+01
               136           137           138           139           140 
      1   0.115039D+03 -0.608314D+01 -0.208082D+02 -0.446553D+01  0.660422D+01
      2  -0.694247D+02  0.284067D+01  0.190706D+02  0.125762D+01 -0.439094D+01
      3  -0.456140D+02  0.324247D+01  0.173768D+01  0.320792D+01 -0.221328D+01
      4  -0.135413D+02  0.116927D+02  0.377129D+01  0.152614D+02 -0.133259D+01
      5  -0.662438D+02  0.427138D+01  0.302228D+02  0.258516D+01 -0.726192D+01
      6   0.569121D+01 -0.408786D+01 -0.231873D+01 -0.482757D+01  0.274605D+00
               141           142           143           144           145 
      1  -0.153433D+00 -0.770573D+01 -0.131089D+01  0.863231D+01 -0.102583D+01
      2  -0.115963D+00  0.841142D+01  0.315910D-01 -0.701612D+01 -0.926709D+00
      3   0.269396D+00 -0.705695D+00  0.127930D+01 -0.161618D+01  0.195254D+01
      4  -0.592103D+01 -0.252276D-01 -0.328035D+01 -0.111952D+01 -0.368554D+01
      5  -0.108804D+01  0.172971D+02 -0.418185D+00 -0.746299D+01 -0.320897D+01
      6   0.437940D+01 -0.668246D+00  0.257823D+01  0.111259D+01  0.451280D+01
               146           147           148           149           150 
      1  -0.104458D+02 -0.161082D+02 -0.847812D+01 -0.198102D+02 -0.174003D+02
      2   0.380281D+01  0.162263D+01  0.554564D+01  0.808410D+01  0.174938D+00
      3   0.664295D+01  0.144856D+02  0.293248D+01  0.117261D+02  0.172254D+02
      4  -0.492441D+01 -0.307579D+01  0.234691D+01 -0.192219D+02 -0.186609D+02
      5  -0.660246D+00 -0.622383D+01  0.741504D+01 -0.146901D+02 -0.208114D+02
      6   0.695520D+01  0.640302D+01  0.158613D+00  0.187628D+02  0.198142D+02
               151           152           153           154           155 
      1  -0.572637D+01 -0.129651D+02 -0.253688D+02  0.169567D+03  0.362776D+02
      2   0.211442D+01 -0.196878D+00 -0.332185D+01 -0.753020D+02 -0.105265D+02
      3   0.361194D+01  0.131620D+02  0.286906D+02 -0.942647D+02 -0.257511D+02
      4   0.202027D+01 -0.134958D+02 -0.147817D+02  0.624714D+02  0.441228D+02
      5   0.380383D+01 -0.128211D+02 -0.231005D+02  0.123696D+02  0.525689D+01
      6   0.443996D+00  0.151815D+02  0.181647D+02  0.252286D+00  0.917484D+00
               156           157           158           159           160 
      1  -0.467458D+01  0.499159D+02  0.341616D+02 -0.383146D+01 -0.823516D+01
      2  -0.157107D+01 -0.114689D+02 -0.247614D+01 -0.813524D+00  0.230765D+00
      3   0.624564D+01 -0.384469D+02 -0.316854D+02  0.464499D+01  0.800440D+01
      4   0.168568D+01  0.629361D+02  0.517126D+02 -0.460511D+01 -0.612332D+01
      5   0.321530D+02  0.237532D+01  0.221009D+00  0.152565D+02  0.295899D+02
      6   0.564519D+01  0.384537D+01  0.339453D+01  0.662295D+01  0.664347D+01
               161           162           163           164           165 
      1  -0.383647D+01  0.168254D+02  0.499383D+02  0.147988D+02  0.108499D+02
      2  -0.534236D+00 -0.983165D+01 -0.324523D+02 -0.570569D+01 -0.917502D+01
      3   0.437071D+01 -0.699374D+01 -0.174860D+02 -0.909312D+01 -0.167489D+01
      4  -0.923596D+01  0.108747D+02  0.270246D+02  0.115148D+02  0.204903D+01
      5   0.997233D+01 -0.755940D+01  0.293589D+02  0.340831D+01  0.188849D+02
      6   0.537682D+01 -0.540632D+00  0.107142D+02  0.174453D+01  0.748848D+00
               166           167           168           169           170 
      1   0.206649D+02 -0.521039D+01 -0.921734D+01 -0.122362D+02 -0.716604D+01
      2  -0.107686D+02  0.256456D+01  0.156439D+01  0.130384D+01  0.201684D+01
      3  -0.989638D+01  0.264583D+01  0.765295D+01  0.109324D+02  0.514920D+01
      4   0.134201D+02  0.759591D+01  0.113677D+02 -0.606528D+01  0.194247D+01
      5   0.122765D+02  0.121974D+02  0.115889D+02  0.145328D+02  0.388387D+01
      6   0.329999D+01  0.686238D+01  0.124522D+02 -0.531299D+00  0.990438D+01
               171           172           173           174           175 
      1  -0.301958D+02 -0.462806D+02 -0.887899D+01  0.101027D+02 -0.207120D+02
      2  -0.151183D+02  0.259356D+02  0.408218D+01  0.406430D+01  0.137824D+02
      3   0.453141D+02  0.203450D+02  0.479681D+01 -0.141670D+02  0.692964D+01
      4   0.192374D+01 -0.212021D+02 -0.802880D+01 -0.187925D+01 -0.110080D+02
      5   0.454408D+02 -0.216571D+02 -0.471241D+01 -0.150802D+02 -0.122841D+02
      6   0.796022D+01 -0.808746D+01 -0.433382D+01 -0.271038D+01 -0.401174D+01
               176           177           178           179           180 
      1  -0.899821D+01  0.276087D+01 -0.192089D+01  0.574379D+00 -0.115854D+02
      2   0.466294D+01  0.330796D+01  0.758523D+01  0.664487D+00  0.306252D+01
      3   0.433527D+01 -0.606883D+01 -0.566434D+01 -0.123887D+01  0.852292D+01
      4  -0.427335D+01  0.161680D+01 -0.517254D+01 -0.225747D+00 -0.373057D+01
      5   0.597503D+00 -0.908423D+01 -0.841873D+01 -0.164684D+01  0.130019D+01
      6  -0.243762D+01  0.224247D+01 -0.249985D+01  0.150240D+01 -0.211197D+01
               181           182           183           184           185 
      1   0.381547D+02  0.497311D+02 -0.111299D+02 -0.395706D+02  0.188962D+02
      2  -0.246055D+02 -0.380632D+02  0.528748D+01  0.264821D+02 -0.214339D+02
      3  -0.135492D+02 -0.116679D+02  0.584247D+01  0.130884D+02  0.253766D+01
      4   0.107987D+02  0.282739D+02 -0.648153D+01  0.116842D+02  0.252165D+02
      5   0.434814D+00 -0.920150D+01  0.119465D+02  0.312580D+01 -0.102117D+02
      6  -0.167058D+01  0.741039D+01 -0.904148D+01 -0.680218D+01  0.850482D+01
               186           187           188           189           190 
      1  -0.181841D+01  0.733133D+01 -0.903337D+01  0.118134D+01  0.969921D+02
      2   0.391653D+01 -0.132613D+02  0.137020D+02 -0.435650D+01 -0.528664D+02
      3  -0.209812D+01  0.592997D+01 -0.466860D+01  0.317515D+01 -0.441257D+02
      4  -0.105973D+02 -0.861357D+00 -0.134474D+02 -0.203028D+02 -0.125529D+02
      5  -0.455895D+01  0.291217D+02 -0.188390D+02  0.782926D+01  0.611653D+01
      6   0.376020D+01 -0.220781D+02  0.161366D+02 -0.495314D+00 -0.605626D+00
               191           192           193           194           195 
      1  -0.222590D+02 -0.614685D+00 -0.860578D+02 -0.334013D+02  0.156162D+02
      2   0.672304D+01 -0.653219D+00  0.462279D+02  0.381225D+02 -0.152604D+02
      3   0.155359D+02  0.126790D+01  0.398299D+02 -0.472119D+01 -0.355778D+00
      4   0.119585D+02 -0.201878D+01 -0.349258D+02 -0.519171D+02  0.989214D+01
      5  -0.223422D+01  0.774596D-01  0.171463D+02  0.879017D+01 -0.653517D+01
      6   0.289370D+01 -0.182903D+01  0.210155D+01 -0.104696D+02 -0.180658D+01
               196           197           198           199           200 
      1   0.154490D+02  0.106016D+02  0.205369D+02 -0.116406D+03 -0.202193D+01
      2  -0.942574D+01 -0.938151D+01 -0.184822D+02  0.547788D+02  0.852371D+01
      3  -0.602322D+01 -0.122010D+01 -0.205467D+01  0.616273D+02 -0.650178D+01
      4   0.152404D+02  0.548187D+01 -0.802899D+01 -0.760248D+01 -0.228220D+02
      5   0.450757D+02 -0.138321D+02  0.201582D+01  0.321687D+01  0.960964D+01
      6  -0.486390D+01  0.622695D+01  0.318751D+01  0.749770D+01 -0.414926D+01
               201           202           203           204           205 
      1   0.757372D+01  0.113080D+03  0.618362D+01 -0.956708D+01 -0.127970D+02
      2  -0.484173D+01 -0.696933D+02 -0.158232D+02  0.841746D+01  0.102045D+02
      3  -0.273199D+01 -0.433870D+02  0.963954D+01  0.114962D+01  0.259249D+01
      4   0.784631D+01  0.142061D+02  0.199694D+02  0.118676D+01  0.556186D+00
      5   0.521149D+01 -0.361974D+01  0.190400D+01  0.958181D+01  0.605401D+01
      6   0.160248D+01  0.321424D+01  0.924753D+01  0.436761D+01  0.338433D+01
               206           207           208           209           210 
      1  -0.893358D+00 -0.110081D+02  0.326537D+02 -0.664935D+01  0.184063D+01
      2   0.397729D+01 -0.504306D+01 -0.185857D+02  0.340519D+01  0.996994D+00
      3  -0.308393D+01  0.160512D+02 -0.140680D+02  0.324416D+01 -0.283763D+01
      4   0.655689D+01  0.186773D+02 -0.191784D+02  0.115132D+02  0.316543D+01
      5   0.220689D+02 -0.866361D+01  0.980277D+00  0.257259D+01  0.235590D+02
      6   0.746101D+01  0.601913D+00  0.196646D+01 -0.102723D+01  0.899360D+00
               211           212           213           214           215 
      1  -0.576780D+01  0.450154D+01  0.161805D+01  0.876759D+00 -0.684972D+00
      2   0.634483D+00  0.953503D-01  0.283902D+01 -0.206070D+00  0.137425D+01
      3   0.513331D+01 -0.459689D+01 -0.445707D+01 -0.670689D+00 -0.689275D+00
      4   0.344860D+02 -0.218424D+02  0.345363D+01 -0.336133D+01  0.945972D+00
      5  -0.208073D+01  0.513859D+01  0.118007D+02  0.128733D+02 -0.787029D+01
      6  -0.856654D+00  0.286591D+01  0.880528D+01 -0.277876D+01  0.435407D+01
               216           217           218           219           220 
      1   0.260952D+01 -0.742988D+02  0.244449D+02  0.261709D+01  0.274064D+02
      2  -0.250332D+01  0.412175D+02 -0.121937D+02 -0.697579D+00 -0.125929D+02
      3  -0.106206D+00  0.330813D+02 -0.122512D+02 -0.191951D+01 -0.148135D+02
      4  -0.803313D+01  0.308019D+02  0.185575D+02 -0.694445D+01 -0.173555D+02
      5  -0.214512D+01  0.114690D+01 -0.672631D+01  0.100027D+02 -0.709035D+01
      6  -0.196224D+01 -0.360827D+01 -0.111996D+01  0.261670D+01 -0.353370D+01
               221           222           223           224           225 
      1   0.469761D+01 -0.867291D+01 -0.952814D+00 -0.559267D+01  0.136389D+02
      2  -0.449990D+01 -0.497355D+01 -0.483910D+01 -0.335340D+01 -0.481262D+01
      3  -0.197710D+00  0.136465D+02  0.579191D+01  0.894607D+01 -0.882626D+01
      4  -0.107776D+02 -0.191283D+02 -0.618718D+01 -0.163551D+02 -0.391178D+02
      5  -0.197008D+02 -0.632476D+02 -0.155172D+02 -0.375835D+02  0.262193D+02
      6  -0.476137D+01 -0.161384D+02 -0.995341D+01 -0.109968D+02  0.798237D+01
               226           227           228           229           230 
      1  -0.898045D+01 -0.184709D+02  0.423962D+01 -0.101859D+02 -0.482944D+02
      2   0.954755D+01  0.197602D+02 -0.321813D+01  0.112931D+02  0.573682D+02
      3  -0.567102D+00 -0.128925D+01 -0.102149D+01 -0.110725D+01 -0.907384D+01
      4   0.405578D+01  0.688800D+01 -0.112403D+01  0.295583D+01 -0.392245D+01
      5  -0.451429D+00 -0.669056D+00  0.113078D+01  0.890817D-01  0.220719D+01
      6  -0.275685D+01 -0.500940D+01  0.351310D+01 -0.289843D+01 -0.137817D+02
               231           232           233           234           235 
      1   0.962155D+01  0.257557D+01  0.100113D+02 -0.278811D+01  0.178969D+02
      2  -0.864639D+01 -0.279137D+01 -0.102773D+02  0.288491D+01  0.185778D+01
      3  -0.975159D+00  0.215799D+00  0.266032D+00 -0.968059D-01 -0.197546D+02
      4   0.101657D+01 -0.381696D+00  0.695501D+00  0.100082D+01 -0.391595D+02
      5  -0.147708D+01  0.208290D+01  0.259017D-01 -0.217172D+00  0.640001D+01
      6   0.888730D+01  0.221796D+00  0.580447D+01 -0.294702D+01 -0.290530D+01
               236           237           238           239           240 
      1  -0.105007D+02  0.116454D+01 -0.740913D+01 -0.429810D+01  0.377754D+00
      2  -0.722592D+01  0.646762D-01 -0.142576D+02  0.321002D+02 -0.206143D+01
      3   0.177266D+02 -0.122922D+01  0.216667D+02 -0.278021D+02  0.168367D+01
      4   0.384722D+02 -0.401830D+01  0.453457D+02 -0.626948D+02  0.710724D+01
      5  -0.559762D+01  0.543713D+01 -0.806750D+01  0.975664D+01 -0.746952D+01
      6   0.306632D+01 -0.352461D+01  0.616986D+01 -0.804057D+01  0.706404D+01
               241           242           243           244           245 
      1  -0.126714D-01  0.929967D+00 -0.163136D+01  0.181822D+02  0.115665D+02
      2   0.304536D+01 -0.366307D+01  0.240073D+01 -0.712677D+01 -0.366608D+01
      3  -0.303269D+01  0.273311D+01 -0.769375D+00 -0.110554D+02 -0.790039D+01
      4  -0.574087D+01  0.774665D+01 -0.461162D+01  0.209492D+02  0.154635D+02
      5   0.871037D+00 -0.401748D+01  0.209023D+01 -0.464749D+01 -0.300632D+01
      6  -0.174766D+00  0.427189D+01 -0.207732D+01 -0.115377D+01 -0.112980D+01
               246           247           248           249           250 
      1  -0.322093D+01  0.139619D+02 -0.533373D+00 -0.665208D+00 -0.383760D+01
      2   0.154579D+01 -0.955261D+00  0.116849D+02 -0.490957D+00  0.147776D+01
      3   0.167515D+01 -0.130066D+02 -0.111515D+02  0.115616D+01  0.235985D+01
      4  -0.368587D+01  0.264336D+02  0.364693D+02 -0.719261D+01 -0.597049D+01
      5   0.273900D+01 -0.502751D+01 -0.576171D+01  0.532077D+01  0.189878D+01
      6   0.113805D+01 -0.247160D+01 -0.409433D+01  0.435877D+01  0.226035D+01
               251           252           253           254           255 
      1  -0.101312D+01 -0.890354D+00 -0.368650D+01 -0.688247D-01 -0.112872D+02
      2  -0.103613D+01  0.168830D+01  0.119856D+01 -0.303212D+00  0.319647D+01
      3   0.204925D+01 -0.797946D+00  0.248794D+01  0.372036D+00  0.809070D+01
      4  -0.754606D+01  0.223499D+01 -0.411889D+01 -0.297199D+01 -0.247866D+00
      5   0.674158D+00 -0.106946D+01 -0.627328D+01  0.192638D+00 -0.722708D+01
      6   0.199988D+01 -0.172184D+01 -0.104897D+01  0.983193D+00 -0.291168D+01
               256           257           258           259           260 
      1   0.512724D+01  0.107845D+01  0.507968D+00 -0.309473D+02 -0.309525D+01
      2  -0.295845D+01  0.169713D+00  0.942052D+00  0.215473D+02  0.336444D+01
      3  -0.216879D+01 -0.124816D+01 -0.145002D+01  0.939994D+01 -0.269189D+00
      4   0.172085D+02  0.174999D+02 -0.167815D+02 -0.182592D+02 -0.164037D+02
      5  -0.117969D+02 -0.153192D+02  0.271762D+02  0.351026D+02  0.231567D+02
      6  -0.437656D+01 -0.666449D+01  0.114299D+02  0.932550D+01  0.981183D+01
               261           262           263           264           265 
      1  -0.226969D+01  0.205318D+03 -0.153764D+02 -0.810964D+01 -0.419091D+02
      2  -0.128258D+02 -0.108055D+03  0.887577D+01  0.513627D+01  0.229967D+02
      3   0.150955D+02 -0.972627D+02  0.650058D+01  0.297337D+01  0.189124D+02
      4   0.254845D+02 -0.608099D+01  0.149674D+02  0.955212D+00  0.201164D+02
      5  -0.663279D+02 -0.119320D+02  0.157940D+01  0.170780D+02  0.335480D+01
      6  -0.161765D+02  0.190821D+01 -0.836026D+00  0.577241D+00 -0.137150D+01
               266           267           268           269           270 
      1   0.184644D+02  0.203096D+01 -0.295696D+01  0.641821D+00  0.151731D+02
      2  -0.908221D+01 -0.934429D+00  0.261059D+01  0.131855D+00 -0.917245D+01
      3  -0.938218D+01 -0.109653D+01  0.346367D+00 -0.773677D+00 -0.600068D+01
      4  -0.992059D+01  0.679401D+00  0.111023D+01  0.161417D+01  0.185974D+01
      5   0.351604D+00 -0.221084D+01  0.227640D+02  0.101170D+01 -0.401585D+01
      6   0.106610D+01  0.147388D+01  0.445945D+00  0.195430D+01 -0.345359D+00
               271           272           273           274           275 
      1   0.427552D+01  0.467477D+01  0.944355D+01  0.207393D+02  0.841916D+01
      2  -0.108282D+01 -0.248499D+01 -0.498317D+01 -0.595167D+01  0.506400D+01
      3  -0.319270D+01 -0.218978D+01 -0.446037D+01 -0.147877D+02 -0.134832D+02
      4   0.242266D+01  0.824305D+00  0.250166D+01  0.346974D+02  0.422466D+02
      5   0.949875D+01  0.152093D+01 -0.385878D+01  0.159060D+02  0.248987D+02
      6   0.198357D+01 -0.110747D+00 -0.194262D+01  0.618204D+01  0.886650D+01
               276           277           278           279 
      1   0.313360D+01  0.334926D+02  0.742203D+01  0.115149D+01
      2   0.331592D+01 -0.151081D+02 -0.172723D+00 -0.181144D+01
      3  -0.644952D+01 -0.183845D+02 -0.724930D+01  0.659951D+00
      4   0.253435D+02  0.254452D+02  0.271362D+02  0.268308D+02
      5   0.285830D+02  0.238206D+02  0.259740D+02  0.356890D+02
      6   0.958741D+01  0.849286D+01  0.948870D+01  0.101392D+02
 End of Minotr F.D. properties file   788 does not exist.
 Leave Link 1002 at Thu Aug 12 21:39:35 2021, MaxMem=  5368709120 cpu:           25488.1 elap:            3194.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l601.exe)
 Copying SCF densities to generalized density rwf, IOpCl= 0 IROHF=0.

 **********************************************************************

            Population analysis using the SCF density.

 **********************************************************************

 Orbital symmetries:
       Occupied  (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A)
       Virtual   (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A)
 The electronic state is 1-A.
 Alpha  occ. eigenvalues --  -19.18865 -19.18842 -19.13032 -10.32141 -10.26488
 Alpha  occ. eigenvalues --  -10.25542 -10.22098 -10.21455 -10.21334 -10.21000
 Alpha  occ. eigenvalues --  -10.20654 -10.20645 -10.20606 -10.20474 -10.20250
 Alpha  occ. eigenvalues --  -10.19959 -10.18697  -1.09699  -1.07679  -1.01621
 Alpha  occ. eigenvalues --   -0.89045  -0.84678  -0.80393  -0.78278  -0.75617
 Alpha  occ. eigenvalues --   -0.73317  -0.70899  -0.66212  -0.64059  -0.62293
 Alpha  occ. eigenvalues --   -0.61447  -0.60283  -0.55309  -0.54058  -0.53213
 Alpha  occ. eigenvalues --   -0.51390  -0.48906  -0.48621  -0.46818  -0.46620
 Alpha  occ. eigenvalues --   -0.46273  -0.45463  -0.44249  -0.43219  -0.42884
 Alpha  occ. eigenvalues --   -0.42490  -0.41592  -0.40482  -0.39324  -0.38385
 Alpha  occ. eigenvalues --   -0.37213  -0.36874  -0.36284  -0.35681  -0.34559
 Alpha  occ. eigenvalues --   -0.32870  -0.32368  -0.30512  -0.28133  -0.25416
 Alpha  occ. eigenvalues --   -0.22978
 Alpha virt. eigenvalues --   -0.06183  -0.03246  -0.00932  -0.00185   0.00514
 Alpha virt. eigenvalues --    0.01237   0.02583   0.03630   0.03959   0.04276
 Alpha virt. eigenvalues --    0.04681   0.06111   0.06149   0.07006   0.07142
 Alpha virt. eigenvalues --    0.07626   0.09265   0.09502   0.10137   0.10291
 Alpha virt. eigenvalues --    0.10597   0.11477   0.11698   0.12012   0.12454
 Alpha virt. eigenvalues --    0.12756   0.13426   0.13765   0.14521   0.14786
 Alpha virt. eigenvalues --    0.15283   0.15483   0.16299   0.17044   0.17370
 Alpha virt. eigenvalues --    0.18118   0.18225   0.18976   0.19144   0.19537
 Alpha virt. eigenvalues --    0.19617   0.20872   0.21236   0.21478   0.21709
 Alpha virt. eigenvalues --    0.22483   0.23134   0.23500   0.23985   0.24283
 Alpha virt. eigenvalues --    0.24450   0.25284   0.25799   0.26022   0.26623
 Alpha virt. eigenvalues --    0.27109   0.27271   0.27516   0.27773   0.28607
 Alpha virt. eigenvalues --    0.29050   0.29180   0.29925   0.30259   0.30742
 Alpha virt. eigenvalues --    0.30965   0.31166   0.31645   0.31925   0.32334
 Alpha virt. eigenvalues --    0.32965   0.33515   0.33579   0.33804   0.34235
 Alpha virt. eigenvalues --    0.34618   0.34703   0.35172   0.35537   0.35832
 Alpha virt. eigenvalues --    0.36126   0.36432   0.36729   0.37242   0.37667
 Alpha virt. eigenvalues --    0.37874   0.38445   0.38548   0.38909   0.39488
 Alpha virt. eigenvalues --    0.39622   0.40078   0.40316   0.40613   0.40732
 Alpha virt. eigenvalues --    0.40994   0.41345   0.42223   0.42308   0.42497
 Alpha virt. eigenvalues --    0.42652   0.43174   0.43861   0.44498   0.44850
 Alpha virt. eigenvalues --    0.44980   0.45223   0.46189   0.46261   0.46359
 Alpha virt. eigenvalues --    0.47332   0.47544   0.47869   0.48192   0.48636
 Alpha virt. eigenvalues --    0.49068   0.49300   0.49402   0.50194   0.50906
 Alpha virt. eigenvalues --    0.51474   0.51774   0.52146   0.52682   0.53051
 Alpha virt. eigenvalues --    0.53113   0.53639   0.54272   0.54558   0.55176
 Alpha virt. eigenvalues --    0.55837   0.56440   0.56768   0.57302   0.57520
 Alpha virt. eigenvalues --    0.58125   0.58438   0.59602   0.59658   0.60057
 Alpha virt. eigenvalues --    0.60287   0.60656   0.61158   0.61930   0.62378
 Alpha virt. eigenvalues --    0.62976   0.63809   0.64223   0.64868   0.65334
 Alpha virt. eigenvalues --    0.65926   0.66444   0.66590   0.67534   0.67763
 Alpha virt. eigenvalues --    0.68235   0.68863   0.68988   0.70236   0.70313
 Alpha virt. eigenvalues --    0.71162   0.71940   0.72280   0.72517   0.73755
 Alpha virt. eigenvalues --    0.74081   0.74485   0.74815   0.75807   0.76466
 Alpha virt. eigenvalues --    0.76564   0.77206   0.77469   0.78539   0.79575
 Alpha virt. eigenvalues --    0.80500   0.81403   0.82063   0.82510   0.82881
 Alpha virt. eigenvalues --    0.84096   0.84550   0.85826   0.86201   0.86931
 Alpha virt. eigenvalues --    0.87723   0.88299   0.88782   0.89174   0.91168
 Alpha virt. eigenvalues --    0.92040   0.92283   0.93166   0.94880   0.95873
 Alpha virt. eigenvalues --    0.95986   0.96413   0.97364   0.98238   0.98342
 Alpha virt. eigenvalues --    0.99322   0.99910   1.00426   1.01489   1.02064
 Alpha virt. eigenvalues --    1.02278   1.03191   1.04110   1.04975   1.05597
 Alpha virt. eigenvalues --    1.05860   1.05967   1.07058   1.08424   1.09760
 Alpha virt. eigenvalues --    1.10327   1.10952   1.12499   1.14498   1.15182
 Alpha virt. eigenvalues --    1.16221   1.16405   1.17999   1.18498   1.18987
 Alpha virt. eigenvalues --    1.19910   1.20181   1.21043   1.21861   1.23490
 Alpha virt. eigenvalues --    1.24302   1.25255   1.26397   1.27439   1.28606
 Alpha virt. eigenvalues --    1.29181   1.30053   1.30686   1.31701   1.33403
 Alpha virt. eigenvalues --    1.34086   1.35657   1.36004   1.37553   1.37918
 Alpha virt. eigenvalues --    1.39078   1.40382   1.42581   1.43280   1.44592
 Alpha virt. eigenvalues --    1.46460   1.47206   1.48316   1.48992   1.50411
 Alpha virt. eigenvalues --    1.50963   1.52720   1.53474   1.54563   1.56448
 Alpha virt. eigenvalues --    1.57149   1.58618   1.59046   1.59478   1.59830
 Alpha virt. eigenvalues --    1.61643   1.62379   1.64550   1.64715   1.65655
 Alpha virt. eigenvalues --    1.66659   1.68134   1.69176   1.69454   1.70234
 Alpha virt. eigenvalues --    1.72159   1.72969   1.73654   1.75238   1.75893
 Alpha virt. eigenvalues --    1.77699   1.78718   1.79459   1.81057   1.81474
 Alpha virt. eigenvalues --    1.83139   1.84845   1.85113   1.85645   1.86615
 Alpha virt. eigenvalues --    1.87359   1.87941   1.88349   1.89222   1.90875
 Alpha virt. eigenvalues --    1.90983   1.92311   1.94111   1.95301   1.96928
 Alpha virt. eigenvalues --    1.97252   1.97891   1.98355   2.00054   2.01631
 Alpha virt. eigenvalues --    2.02635   2.02739   2.03414   2.04690   2.05498
 Alpha virt. eigenvalues --    2.06191   2.06789   2.07120   2.08390   2.09610
 Alpha virt. eigenvalues --    2.10062   2.11455   2.12569   2.13566   2.14769
 Alpha virt. eigenvalues --    2.15309   2.17704   2.20563   2.21018   2.22326
 Alpha virt. eigenvalues --    2.22999   2.24669   2.25960   2.27815   2.29016
 Alpha virt. eigenvalues --    2.29453   2.30830   2.32541   2.33141   2.34469
 Alpha virt. eigenvalues --    2.36008   2.37486   2.37650   2.38948   2.40499
 Alpha virt. eigenvalues --    2.42033   2.43675   2.45032   2.45833   2.46940
 Alpha virt. eigenvalues --    2.48217   2.50581   2.51109   2.52660   2.55131
 Alpha virt. eigenvalues --    2.55562   2.56407   2.57991   2.58291   2.60185
 Alpha virt. eigenvalues --    2.64397   2.65237   2.67702   2.69823   2.72428
 Alpha virt. eigenvalues --    2.77096   2.78112   2.82561   2.85316   2.86700
 Alpha virt. eigenvalues --    2.87295   2.90725   2.91597   2.91730   2.93834
 Alpha virt. eigenvalues --    2.93924   2.95139   2.95468   2.97416   2.97757
 Alpha virt. eigenvalues --    3.00046   3.02445   3.04558   3.06920   3.07832
 Alpha virt. eigenvalues --    3.09237   3.10118   3.11075   3.13443   3.14708
 Alpha virt. eigenvalues --    3.16868   3.19229   3.19471   3.20480   3.25178
 Alpha virt. eigenvalues --    3.27007   3.32779   3.45516   3.46354   3.58845
 Alpha virt. eigenvalues --    3.59694   3.62600   3.79542   3.83444   3.97736
          Condensed to atoms (all electrons):
               1          2          3          4          5          6
     1  C   12.857868  -2.425712  -1.756735   0.092079  -0.342557   0.016780
     2  C   -2.425712  13.764085   0.548276  -1.314617   0.645704  -1.260562
     3  C   -1.756735   0.548276  10.513226  -2.433953  -0.098575  -0.188012
     4  C    0.092079  -1.314617  -2.433953  15.019406  -1.323970   1.017451
     5  C   -0.342557   0.645704  -0.098575  -1.323970  10.498114  -1.037834
     6  C    0.016780  -1.260562  -0.188012   1.017451  -1.037834   8.886930
     7  C   -0.245114  -0.792574  -0.441507   0.165914   0.071139   0.156220
     8  H   -0.899395   0.232948   0.478592  -2.065605   0.008203   0.202887
     9  H    0.170957  -0.124424   0.116358  -1.733477   0.269598  -0.960579
    10  H    0.219131  -1.423581   0.186429  -0.072899  -1.128279  -0.067816
    11  C    0.014827   0.130722  -0.728068  -0.003217  -1.068852   0.019258
    12  C   -0.002709  -0.000748  -0.105809   0.143074  -0.039959   0.005401
    13  C   -0.026938  -0.016147  -0.220980   0.450294  -0.128514   0.002359
    14  H    0.026499   0.012551   0.209444  -0.521436  -0.056729   0.004253
    15  H   -0.001542   0.001521   0.027333  -0.063302   0.004103   0.000508
    16  H   -0.001139  -0.000250  -0.017518   0.019906  -0.023544   0.000131
    17  H    0.002071   0.001736   0.041141  -0.101021   0.075597  -0.007136
    18  O    0.000784   0.000946   0.067193  -0.067079   0.034817  -0.000465
    19  O    0.010079  -0.001400  -0.027468  -0.018072   0.027498  -0.000646
    20  H    0.005907   0.002351   0.012390  -0.055611  -0.015683   0.003097
    21  C    0.185793  -0.405983   0.091227  -0.011788  -0.005949  -0.045108
    22  C   -0.853880   0.139270   0.053682   0.021732   0.006889   0.092444
    23  C   -0.213909  -0.830061  -0.008369   0.153921  -0.054289  -0.913197
    24  O    0.051351   0.034750  -0.006272  -0.002139  -0.000022  -0.011589
    25  C   -0.008743   0.007870   0.000061  -0.000245   0.000040  -0.008108
    26  H   -0.372272   0.165437  -0.114866   0.004251  -0.016593  -0.021515
    27  H   -0.051100   0.022802   0.003689   0.000987   0.000785   0.003004
    28  H    0.039062  -0.293716   0.002445  -0.015821   0.042841   0.077306
    29  H    0.001582   0.004244  -0.000114   0.000023   0.000021   0.000614
    30  H   -0.001187  -0.004951   0.000025   0.000006  -0.000002   0.000026
    31  H    0.001488   0.003766  -0.000107   0.000020   0.000039   0.000235
               7          8          9         10         11         12
     1  C   -0.245114  -0.899395   0.170957   0.219131   0.014827  -0.002709
     2  C   -0.792574   0.232948  -0.124424  -1.423581   0.130722  -0.000748
     3  C   -0.441507   0.478592   0.116358   0.186429  -0.728068  -0.105809
     4  C    0.165914  -2.065605  -1.733477  -0.072899  -0.003217   0.143074
     5  C    0.071139   0.008203   0.269598  -1.128279  -1.068852  -0.039959
     6  C    0.156220   0.202887  -0.960579  -0.067816   0.019258   0.005401
     7  C    8.139570  -0.264629  -0.001964   0.009079  -0.011223   0.002183
     8  H   -0.264629   3.693132   0.063370  -0.024202  -0.329133  -0.027908
     9  H   -0.001964   0.063370   4.391861  -1.150047  -0.547915  -0.052346
    10  H    0.009079  -0.024202  -1.150047   4.171676   0.026430   0.001293
    11  C   -0.011223  -0.329133  -0.547915   0.026430   8.233459   0.388155
    12  C    0.002183  -0.027908  -0.052346   0.001293   0.388155   4.160292
    13  C   -0.002802  -0.092732  -0.041971   0.000922  -0.352477   0.061691
    14  H    0.000962   0.043061   0.078418  -0.003494  -0.050849  -0.237956
    15  H   -0.001584   0.013919   0.000266   0.000127   0.061633   0.208357
    16  H   -0.000118  -0.002340  -0.007632   0.000053   0.203479   0.174199
    17  H    0.000534   0.004802   0.033918  -0.001008   0.162669   0.104803
    18  O    0.000243   0.015733   0.007149  -0.000132  -0.026606  -0.013997
    19  O    0.001492   0.011821  -0.003543  -0.000325   0.042873   0.008095
    20  H    0.000801  -0.003111   0.004461   0.000131  -0.048560   0.001109
    21  C   -0.241598   0.039083   0.001037  -0.024273   0.000191   0.000004
    22  C    0.587840  -0.003390  -0.000464  -0.035894  -0.000577  -0.000159
    23  C   -0.481940  -0.020649   0.010328  -0.204623   0.000166  -0.000204
    24  O   -0.006546  -0.000808   0.000092  -0.000811   0.000005   0.000007
    25  C   -0.005674  -0.000009  -0.000026  -0.000989  -0.000004  -0.000000
    26  H   -0.844847  -0.208248   0.000609   0.000043   0.000426   0.001069
    27  H    0.021230  -0.000194  -0.000021   0.000590  -0.000007  -0.000001
    28  H    0.070676   0.002557  -0.001382  -0.051758   0.000108  -0.000020
    29  H    0.000440  -0.000002   0.000001  -0.000121  -0.000000  -0.000000
    30  H    0.000274   0.000001   0.000000   0.000019  -0.000000  -0.000000
    31  H    0.000370  -0.000002   0.000002  -0.000229  -0.000001   0.000000
              13         14         15         16         17         18
     1  C   -0.026938   0.026499  -0.001542  -0.001139   0.002071   0.000784
     2  C   -0.016147   0.012551   0.001521  -0.000250   0.001736   0.000946
     3  C   -0.220980   0.209444   0.027333  -0.017518   0.041141   0.067193
     4  C    0.450294  -0.521436  -0.063302   0.019906  -0.101021  -0.067079
     5  C   -0.128514  -0.056729   0.004103  -0.023544   0.075597   0.034817
     6  C    0.002359   0.004253   0.000508   0.000131  -0.007136  -0.000465
     7  C   -0.002802   0.000962  -0.001584  -0.000118   0.000534   0.000243
     8  H   -0.092732   0.043061   0.013919  -0.002340   0.004802   0.015733
     9  H   -0.041971   0.078418   0.000266  -0.007632   0.033918   0.007149
    10  H    0.000922  -0.003494   0.000127   0.000053  -0.001008  -0.000132
    11  C   -0.352477  -0.050849   0.061633   0.203479   0.162669  -0.026606
    12  C    0.061691  -0.237956   0.208357   0.174199   0.104803  -0.013997
    13  C    5.926857  -0.181272   0.067869  -0.063424  -0.018754  -0.059560
    14  H   -0.181272   1.482126  -0.005744   0.035345  -0.016563   0.005284
    15  H    0.067869  -0.005744   0.795692  -0.028689   0.011355  -0.003721
    16  H   -0.063424   0.035345  -0.028689   0.778563  -0.057113   0.004545
    17  H   -0.018754  -0.016563   0.011355  -0.057113   0.851527   0.012347
    18  O   -0.059560   0.005284  -0.003721   0.004545   0.012347   8.471517
    19  O   -0.161074   0.004865  -0.010269   0.007485  -0.000227   0.067653
    20  H    0.135157   0.004915   0.001038  -0.000993  -0.000220  -0.019895
    21  C   -0.000347   0.000039   0.000001   0.000001   0.000009   0.000045
    22  C    0.000285  -0.000060   0.000015   0.000002  -0.000031  -0.000013
    23  C   -0.000925   0.000568  -0.000004  -0.000012   0.000109   0.000066
    24  O   -0.000005   0.000001  -0.000001  -0.000000   0.000001  -0.000000
    25  C    0.000001  -0.000000  -0.000000   0.000000  -0.000000  -0.000000
    26  H   -0.000843   0.000109  -0.000871  -0.000025   0.000106   0.000126
    27  H    0.000017  -0.000000  -0.000001   0.000000  -0.000001  -0.000000
    28  H   -0.000049   0.000016  -0.000001  -0.000000   0.000000   0.000002
    29  H    0.000000  -0.000000   0.000000   0.000000  -0.000000  -0.000000
    30  H   -0.000000  -0.000000   0.000000   0.000000  -0.000000   0.000000
    31  H    0.000000  -0.000000   0.000000   0.000000  -0.000000  -0.000000
              19         20         21         22         23         24
     1  C    0.010079   0.005907   0.185793  -0.853880  -0.213909   0.051351
     2  C   -0.001400   0.002351  -0.405983   0.139270  -0.830061   0.034750
     3  C   -0.027468   0.012390   0.091227   0.053682  -0.008369  -0.006272
     4  C   -0.018072  -0.055611  -0.011788   0.021732   0.153921  -0.002139
     5  C    0.027498  -0.015683  -0.005949   0.006889  -0.054289  -0.000022
     6  C   -0.000646   0.003097  -0.045108   0.092444  -0.913197  -0.011589
     7  C    0.001492   0.000801  -0.241598   0.587840  -0.481940  -0.006546
     8  H    0.011821  -0.003111   0.039083  -0.003390  -0.020649  -0.000808
     9  H   -0.003543   0.004461   0.001037  -0.000464   0.010328   0.000092
    10  H   -0.000325   0.000131  -0.024273  -0.035894  -0.204623  -0.000811
    11  C    0.042873  -0.048560   0.000191  -0.000577   0.000166   0.000005
    12  C    0.008095   0.001109   0.000004  -0.000159  -0.000204   0.000007
    13  C   -0.161074   0.135157  -0.000347   0.000285  -0.000925  -0.000005
    14  H    0.004865   0.004915   0.000039  -0.000060   0.000568   0.000001
    15  H   -0.010269   0.001038   0.000001   0.000015  -0.000004  -0.000001
    16  H    0.007485  -0.000993   0.000001   0.000002  -0.000012  -0.000000
    17  H   -0.000227  -0.000220   0.000009  -0.000031   0.000109   0.000001
    18  O    0.067653  -0.019895   0.000045  -0.000013   0.000066  -0.000000
    19  O    8.231142   0.163260  -0.000093  -0.000171  -0.000154   0.000009
    20  H    0.163260   0.592386  -0.000032   0.000007   0.000372  -0.000003
    21  C   -0.000093  -0.000032   8.074363  -0.940761   0.059001  -0.026839
    22  C   -0.000171   0.000007  -0.940761   8.999428  -0.921865  -0.225081
    23  C   -0.000154   0.000372   0.059001  -0.921865   9.779827   0.274344
    24  O    0.000009  -0.000003  -0.026839  -0.225081   0.274344   8.886621
    25  C   -0.000000  -0.000000  -0.003976   0.136124   0.002248   0.122217
    26  H   -0.000120   0.000268  -0.676423   0.123766   0.091253   0.012778
    27  H   -0.000011   0.000000  -0.051500  -0.433825   0.029110   0.060799
    28  H   -0.000037   0.000015   0.112018  -0.943723  -1.026020  -0.269343
    29  H   -0.000000   0.000000  -0.000662   0.028140   0.006468   0.124080
    30  H   -0.000000  -0.000000   0.015615   0.022220   0.075567  -0.309476
    31  H   -0.000000  -0.000000  -0.000659   0.026632   0.007963   0.124987
              25         26         27         28         29         30
     1  C   -0.008743  -0.372272  -0.051100   0.039062   0.001582  -0.001187
     2  C    0.007870   0.165437   0.022802  -0.293716   0.004244  -0.004951
     3  C    0.000061  -0.114866   0.003689   0.002445  -0.000114   0.000025
     4  C   -0.000245   0.004251   0.000987  -0.015821   0.000023   0.000006
     5  C    0.000040  -0.016593   0.000785   0.042841   0.000021  -0.000002
     6  C   -0.008108  -0.021515   0.003004   0.077306   0.000614   0.000026
     7  C   -0.005674  -0.844847   0.021230   0.070676   0.000440   0.000274
     8  H   -0.000009  -0.208248  -0.000194   0.002557  -0.000002   0.000001
     9  H   -0.000026   0.000609  -0.000021  -0.001382   0.000001   0.000000
    10  H   -0.000989   0.000043   0.000590  -0.051758  -0.000121   0.000019
    11  C   -0.000004   0.000426  -0.000007   0.000108  -0.000000  -0.000000
    12  C   -0.000000   0.001069  -0.000001  -0.000020  -0.000000  -0.000000
    13  C    0.000001  -0.000843   0.000017  -0.000049   0.000000  -0.000000
    14  H   -0.000000   0.000109  -0.000000   0.000016  -0.000000  -0.000000
    15  H   -0.000000  -0.000871  -0.000001  -0.000001   0.000000   0.000000
    16  H    0.000000  -0.000025   0.000000  -0.000000   0.000000   0.000000
    17  H   -0.000000   0.000106  -0.000001   0.000000  -0.000000  -0.000000
    18  O   -0.000000   0.000126  -0.000000   0.000002  -0.000000   0.000000
    19  O   -0.000000  -0.000120  -0.000011  -0.000037  -0.000000  -0.000000
    20  H   -0.000000   0.000268   0.000000   0.000015   0.000000  -0.000000
    21  C   -0.003976  -0.676423  -0.051500   0.112018  -0.000662   0.015615
    22  C    0.136124   0.123766  -0.433825  -0.943723   0.028140   0.022220
    23  C    0.002248   0.091253   0.029110  -1.026020   0.006468   0.075567
    24  O    0.122217   0.012778   0.060799  -0.269343   0.124080  -0.309476
    25  C    3.965133   0.001081  -0.021747  -0.085607   0.186814   0.344120
    26  H    0.001081   2.779611  -0.255533  -0.011234   0.000050  -0.000051
    27  H   -0.021747  -0.255533   1.585820   0.019820   0.000641   0.000901
    28  H   -0.085607  -0.011234   0.019820   3.112139  -0.056824   0.090050
    29  H    0.186814   0.000050   0.000641  -0.056824   0.839409  -0.263195
    30  H    0.344120  -0.000051   0.000901   0.090050  -0.263195   2.040169
    31  H    0.186853   0.000052   0.000661  -0.056391   0.007720  -0.263210
              31
     1  C    0.001488
     2  C    0.003766
     3  C   -0.000107
     4  C    0.000020
     5  C    0.000039
     6  C    0.000235
     7  C    0.000370
     8  H   -0.000002
     9  H    0.000002
    10  H   -0.000229
    11  C   -0.000001
    12  C    0.000000
    13  C    0.000000
    14  H   -0.000000
    15  H    0.000000
    16  H    0.000000
    17  H   -0.000000
    18  O   -0.000000
    19  O   -0.000000
    20  H   -0.000000
    21  C   -0.000659
    22  C    0.026632
    23  C    0.007963
    24  O    0.124987
    25  C    0.186853
    26  H    0.000052
    27  H    0.000661
    28  H   -0.056391
    29  H    0.007720
    30  H   -0.263210
    31  H    0.838079
 Mulliken charges:
               1
     1  C   -0.493327
     2  C   -0.824254
     3  C   -0.203159
     4  C   -1.284811
     5  C   -0.344036
     6  C    0.033663
     7  C    0.113151
     8  H    0.132246
     9  H    0.477367
    10  H    0.574556
    11  C   -0.116909
    12  C    1.222082
    13  C    0.723363
    14  H    0.165647
    15  H   -0.078009
    16  H   -0.020910
    17  H   -0.100652
    18  O   -0.496981
    19  O   -0.352663
    20  H    0.216444
    21  C   -0.142437
    22  C    0.121417
    23  C    0.184910
    24  O   -0.833109
    25  C    1.182566
    26  H    0.342406
    27  H    0.063084
    28  H    0.242870
    29  H    0.120673
    30  H   -0.746921
    31  H    0.121730
 Sum of Mulliken charges =  -0.00000
 Mulliken charges with hydrogens summed into heavy atoms:
               1
     1  C   -0.493327
     2  C   -0.824254
     3  C   -0.070913
     4  C   -1.284811
     5  C    0.133332
     6  C    0.608219
     7  C    0.455558
    11  C    0.048737
    12  C    1.022511
    13  C    0.723363
    18  O   -0.496981
    19  O   -0.136219
    21  C   -0.079352
    22  C    0.121417
    23  C    0.427780
    24  O   -0.833109
    25  C    0.678048
 Electronic spatial extent (au):  <R**2>=           5401.2310
 Charge=             -0.0000 electrons
 Dipole moment (field-independent basis, Debye):
    X=              5.2203    Y=              3.2765    Z=              0.7776  Tot=              6.2122
 Quadrupole moment (field-independent basis, Debye-Ang):
   XX=           -113.4369   YY=            -94.8480   ZZ=           -104.3369
   XY=             -5.3340   XZ=             -8.0666   YZ=             -4.3205
 Traceless Quadrupole moment (field-independent basis, Debye-Ang):
   XX=             -9.2296   YY=              9.3593   ZZ=             -0.1297
   XY=             -5.3340   XZ=             -8.0666   YZ=             -4.3205
 Octapole moment (field-independent basis, Debye-Ang**2):
  XXX=            206.6718  YYY=             -4.3414  ZZZ=             -6.0796  XYY=              9.9559
  XXY=             85.2835  XXZ=             16.5857  XZZ=              2.2306  YZZ=              1.3244
  YYZ=              0.8461  XYZ=              5.7039
 Hexadecapole moment (field-independent basis, Debye-Ang**3):
 XXXX=          -6137.4120 YYYY=           -767.0788 ZZZZ=           -466.0284 XXXY=            -76.8684
 XXXZ=           -156.5957 YYYX=            -13.4656 YYYZ=            -15.3331 ZZZX=             -3.4708
 ZZZY=              0.4203 XXYY=          -1124.9426 XXZZ=          -1095.0896 YYZZ=           -223.6389
 XXYZ=            -44.1542 YYXZ=              1.6272 ZZXY=             -3.4236
 N-N= 1.136415014038D+03 E-N=-4.055482907932D+03  KE= 7.590759504950D+02
 No NMR shielding tensors so no spin-rotation constants.
 Leave Link  601 at Thu Aug 12 21:39:36 2021, MaxMem=  5368709120 cpu:               2.2 elap:               0.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l716.exe)
 Electric field and nuclear coordinate derivatives read from checkpoint file.
 Rotating derivatives to standard orientation.
 Dipole        = 2.03985586D+00 1.24897840D+00 2.79794449D-01
 Polarizability= 2.69966724D+02-8.74665879D+00 1.63259685D+02
                -9.92468520D+00-7.70018486D+00 1.12641812D+02
 Translational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000        0.0000    0.0000        0.0000    0.0000
 2     -0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 3      0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 4      0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 5      0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 6      0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 Translational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000        5.1374    5.1373       -6.2973   -6.2973
 2     -5.1374   -5.1373        4.2519    4.2518      -62.8854  -62.8836
 3      6.2973    6.2973       91.4109   91.4106       -4.2544   -4.2518
 4     -4.2519   -4.2518        0.0000    0.0000        6.2971    6.2973
 5    -28.5256  -28.5269       -6.2971   -6.2973        5.1363    5.1373
 6      4.2544    4.2518       -5.1363   -5.1373       -0.0000    0.0000
 Translational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000      -15.4119  -15.4119      -18.8918  -18.8918
 2    -12.7555  -12.7555       -0.0000    0.0000      -18.8918  -18.8918
 3    -12.7555  -12.7555      -15.4119  -15.4119       -0.0000    0.0000
 4    -15.4119  -15.4119       12.7555   12.7555     -188.6509 -188.6509
 5     18.8918   18.8918      274.2318  274.2318      -12.7555  -12.7555
 6    -85.5808  -85.5808      -18.8918  -18.8918       15.4119   15.4119
 Rotational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.1713    0.0000      -20.3774  -20.5493       25.4089   25.1891
 2     20.5497   20.5493      -17.1580  -17.0074      251.4221  251.5346
 3    -25.2675  -25.1891     -365.6115 -365.6424       16.9765   17.0074
 4     16.9947   17.0074        0.0045    0.0000      -25.1187  -25.1891
 5    113.9815  114.1078       25.3522   25.1891      -20.7325  -20.5493
 6    -17.0041  -17.0074       20.7094   20.5493        0.0565    0.0000
 Rotational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0284    0.0000       34.9303   34.6779        7.0161    6.9812
 2    -34.5610  -34.6779      -90.1901  -89.9071        4.2820    4.2232
 3     -6.7056   -6.9812       65.8699   65.4044       89.8525   89.9071
 4     89.9248   89.9071       -0.0287    0.0000       -7.0574   -6.9812
 5    -69.5200  -69.6276        7.1534    6.9812       34.6705   34.6779
 6    -89.9367  -89.9071      -34.6575  -34.6779        0.1542    0.0000
 Rotational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     41.1080   40.9875       43.5183   43.8529        5.9407    5.9848
 2    189.5031  189.3684      114.3451  114.5981        5.7157    5.9848
 3    189.4592  189.3684       43.6323   43.8529       -2.6163   -2.3926
 4    -70.6581  -70.7451     -148.6831 -148.3809       19.0847   19.0901
 5     -8.0733   -8.3774       71.5898   71.2902      148.4690  148.3809
 6    -90.2563  -90.3803        9.2022    8.3774       70.8787   70.7451
 Full mass-weighted force constant matrix:
 Low frequencies ---   -2.9330   -1.2631   -0.0005    0.0001    0.0007    3.6137
 Low frequencies ---   20.9639   30.9939   46.3843
 Diagonal vibrational polarizability:
      126.3919677     136.0127577      98.8231612
 Harmonic frequencies (cm**-1), IR intensities (KM/Mole), Raman scattering
 activities (A**4/AMU), depolarization ratios for plane and unpolarized
 incident light, reduced masses (AMU), force constants (mDyne/A),
 Raman invariants Alpha2 = alpha**2, Beta2 = beta(alpha)**2 (A**4/AMU)
 ROA invariants AlphaG = alphaG', Gamma2 = beta(G')**2, Delta2 = beta(A)**2, (10**4 A**5/AMU)
 Far-From-Resonance Raman intensities (K), ROA intensites (10**4 K), CID=(ROA/Raman)*10**4
    Raman1;ROA1;CID1 =ICPu/SCPu(180), Raman2;ROA2;CID2 =ICPd/SCPd(90)
    Raman3;ROA3;CID3 =DCPI(180) RC180 = degree of circularity
 and normal coordinates:
 Incident light (cm**-1):   19436.35
                      1                      2                      3
                      A                      A                      A
 Frequencies --     20.9332                30.9816                46.3837
 Red. masses --      4.6169                 7.2286                 5.1424
 Frc consts  --      0.0012                 0.0041                 0.0065
 IR Inten    --      2.4872                 5.1536                 0.2753
 RamAct Fr= 1--      4.0849                 2.5115                 3.5574
  Dep-P Fr= 1--      0.7445                 0.7459                 0.7397
  Dep-U Fr= 1--      0.8535                 0.8545                 0.8504
 Alpha2 Fr= 1--      0.0004                 0.0002                 0.0006
 Beta2  Fr= 1--      0.5811                 0.3577                 0.5042
 AlphaG Fr= 1--     -0.0019                 0.0073                 0.0043
 Gamma2 Fr= 1--      0.7603                -0.6422                 1.9853
 Delta2 Fr= 1--      0.9502                -0.7443                 0.5233
 Raman1 Fr= 1--      16.340                 10.046                 14.230
 ROA1   Fr= 1--     103.391                -85.465                207.337
 CID1   Fr= 1--       6.328                 -8.507                 14.571
 Raman2 Fr= 1--       6.973                  4.292                  6.050
 ROA2   Fr= 1--      10.645                 -9.457                 43.461
 CID2   Fr= 1--       1.527                 -2.203                  7.184
 Raman3 Fr= 1--      13.947                  8.584                 12.100
 ROA3   Fr= 1--     103.391                -85.465                207.337
 CID3   Fr= 1--       7.413                 -9.956                 17.135
 RC180  Fr= 1--       0.707                  0.709                  0.701
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01   0.00  -0.11    -0.02   0.02   0.06    -0.02   0.03   0.09
     2   6     0.01   0.02   0.02    -0.01  -0.00  -0.00    -0.01   0.04   0.13
     3   6    -0.02   0.01  -0.14    -0.02   0.03   0.07    -0.02   0.04   0.07
     4   6     0.00   0.03  -0.07    -0.01   0.03   0.03    -0.01   0.04   0.07
     5   6     0.02   0.05   0.04    -0.01   0.01  -0.03     0.00   0.05   0.15
     6   6     0.02   0.04   0.09    -0.01  -0.00  -0.05     0.00   0.05   0.19
     7   6    -0.03  -0.02  -0.18    -0.03   0.02   0.11    -0.03   0.02   0.03
     8   1    -0.03   0.00  -0.23    -0.03   0.04   0.10    -0.03   0.03   0.02
     9   1     0.04   0.06   0.10    -0.00   0.01  -0.06     0.01   0.06   0.17
    10   1     0.04   0.05   0.17    -0.00  -0.02  -0.09     0.01   0.06   0.24
    11   6     0.00   0.05  -0.07    -0.01   0.02   0.01    -0.02   0.03  -0.06
    12   6     0.02   0.23  -0.04    -0.04   0.00  -0.01    -0.15   0.12  -0.08
    13   6     0.01  -0.08   0.06     0.07  -0.01  -0.02     0.09  -0.06  -0.05
    14   1    -0.00   0.01  -0.19    -0.02   0.01  -0.00    -0.01  -0.00  -0.16
    15   1     0.02   0.27   0.07    -0.06  -0.00  -0.01    -0.15   0.16   0.02
    16   1     0.02   0.24  -0.02    -0.04   0.00  -0.02    -0.15   0.09  -0.18
    17   1     0.03   0.30  -0.14    -0.06  -0.01   0.01    -0.23   0.18  -0.10
    18   8     0.09  -0.16   0.18     0.28  -0.35   0.06     0.07  -0.06  -0.10
    19   8    -0.08  -0.10   0.01    -0.09   0.36  -0.15     0.20  -0.14   0.02
    20   1    -0.12  -0.02  -0.09    -0.20   0.58  -0.21     0.20  -0.13   0.06
    21   6    -0.03  -0.03  -0.13    -0.03  -0.00   0.09    -0.04  -0.01  -0.03
    22   6    -0.01  -0.01  -0.01    -0.02  -0.02   0.02    -0.03  -0.01  -0.02
    23   6     0.01   0.01   0.06    -0.02  -0.02  -0.03    -0.01   0.01   0.08
    24   8    -0.01  -0.02   0.03    -0.03  -0.04  -0.01    -0.04  -0.04  -0.14
    25   6     0.02  -0.00   0.17    -0.02  -0.06  -0.10    -0.03  -0.06  -0.23
    26   1    -0.05  -0.03  -0.27    -0.03   0.03   0.16    -0.04   0.02   0.02
    27   1    -0.04  -0.04  -0.19    -0.04   0.00   0.12    -0.05  -0.02  -0.09
    28   1     0.03   0.02   0.16    -0.01  -0.03  -0.08    -0.00   0.01   0.09
    29   1     0.06   0.09   0.20    -0.04  -0.11  -0.11    -0.14  -0.06  -0.19
    30   1     0.02  -0.01   0.19    -0.02  -0.07  -0.11    -0.04  -0.09  -0.35
    31   1    -0.01  -0.07   0.23     0.01  -0.01  -0.14     0.09  -0.06  -0.21
                      4                      5                      6
                      A                      A                      A
 Frequencies --     90.6615               121.1625               144.1336
 Red. masses --      3.9827                 4.3007                 4.3281
 Frc consts  --      0.0193                 0.0372                 0.0530
 IR Inten    --      3.4036                 0.0874                 0.1758
 RamAct Fr= 1--      1.0106                 0.4143                 1.1021
  Dep-P Fr= 1--      0.7024                 0.4515                 0.6520
  Dep-U Fr= 1--      0.8252                 0.6221                 0.7893
 Alpha2 Fr= 1--      0.0008                 0.0025                 0.0019
 Beta2  Fr= 1--      0.1390                 0.0430                 0.1450
 AlphaG Fr= 1--     -0.0027                -0.0095                -0.0099
 Gamma2 Fr= 1--     -0.7043                -0.2188                 1.8835
 Delta2 Fr= 1--     -0.3674                 0.1335                 1.3483
 Raman1 Fr= 1--       4.043                  1.657                  4.408
 ROA1   Fr= 1--     -79.373                -16.735                223.965
 CID1   Fr= 1--     -19.634                -10.098                 50.805
 Raman2 Fr= 1--       1.668                  0.516                  1.740
 ROA2   Fr= 1--     -13.965                 -6.319                 34.419
 CID2   Fr= 1--      -8.373                -12.258                 19.783
 Raman3 Fr= 1--       3.336                  1.031                  3.480
 ROA3   Fr= 1--     -79.373                -16.735                223.965
 CID3   Fr= 1--     -23.795                -16.231                 64.364
 RC180  Fr= 1--       0.650                  0.244                  0.579
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.02   0.02   0.02    -0.04   0.08  -0.10    -0.01  -0.09  -0.10
     2   6    -0.02   0.00  -0.09    -0.02   0.07  -0.06    -0.03  -0.09  -0.11
     3   6    -0.01   0.05   0.12    -0.03   0.10  -0.10    -0.01  -0.07  -0.00
     4   6    -0.01   0.05   0.09    -0.02   0.11  -0.03     0.01  -0.04   0.10
     5   6    -0.02   0.02  -0.03    -0.02   0.11  -0.01     0.00  -0.05   0.07
     6   6    -0.02  -0.00  -0.11    -0.01   0.09  -0.04    -0.01  -0.07  -0.05
     7   6    -0.04   0.01  -0.00    -0.10   0.05  -0.09     0.01  -0.08  -0.13
     8   1    -0.01   0.07   0.20    -0.04   0.10  -0.12    -0.02  -0.07  -0.01
     9   1    -0.01   0.02  -0.07    -0.00   0.12   0.02     0.01  -0.04   0.14
    10   1    -0.02  -0.02  -0.20    -0.00   0.09  -0.02    -0.00  -0.08  -0.07
    11   6    -0.01   0.02   0.06    -0.00   0.00   0.05     0.00   0.03   0.06
    12   6    -0.07  -0.01   0.04     0.12  -0.19   0.06    -0.13   0.14   0.03
    13   6     0.08  -0.01   0.02     0.06  -0.03   0.03     0.05   0.04   0.03
    14   1    -0.03   0.01   0.05    -0.12  -0.01   0.15     0.07   0.03  -0.01
    15   1    -0.04   0.00   0.05     0.28  -0.18  -0.06    -0.19   0.15   0.14
    16   1    -0.07  -0.07  -0.02     0.12  -0.34   0.14    -0.13   0.18  -0.07
    17   1    -0.14   0.01   0.06     0.07  -0.20   0.11    -0.17   0.17   0.02
    18   8     0.08  -0.03  -0.05     0.06  -0.05  -0.00     0.04   0.02  -0.03
    19   8     0.17  -0.01   0.07     0.12  -0.07   0.06     0.12   0.07   0.06
    20   1     0.16   0.01   0.13     0.11  -0.04   0.09     0.12   0.06   0.11
    21   6    -0.05  -0.02  -0.09    -0.09   0.02   0.01     0.02  -0.04  -0.04
    22   6    -0.04  -0.03  -0.12    -0.05   0.01   0.06     0.01  -0.01   0.03
    23   6    -0.03  -0.02  -0.15    -0.01   0.03  -0.00    -0.03  -0.05  -0.09
    24   8    -0.04  -0.04  -0.11    -0.05  -0.05   0.18     0.03   0.10   0.23
    25   6     0.00   0.02   0.26     0.01  -0.15  -0.07    -0.08   0.10  -0.09
    26   1    -0.05   0.03   0.06    -0.14   0.07  -0.13     0.04  -0.10  -0.17
    27   1    -0.05  -0.02  -0.09    -0.12   0.01   0.04     0.04  -0.02  -0.01
    28   1    -0.02  -0.04  -0.20     0.04   0.02   0.03    -0.06  -0.04  -0.07
    29   1     0.19   0.21   0.29     0.01  -0.33  -0.15    -0.09  -0.24  -0.23
    30   1     0.01   0.03   0.40    -0.01  -0.22  -0.04    -0.05   0.20   0.05
    31   1    -0.16  -0.15   0.38     0.09   0.01  -0.21    -0.19   0.33  -0.33
                      7                      8                      9
                      A                      A                      A
 Frequencies --    182.2079               188.3465               218.4087
 Red. masses --      3.3711                 3.4736                 1.0807
 Frc consts  --      0.0659                 0.0726                 0.0304
 IR Inten    --      0.5494                 1.9241                 0.6819
 RamAct Fr= 1--      4.6545                 2.4658                 0.3581
  Dep-P Fr= 1--      0.3533                 0.3378                 0.4105
  Dep-U Fr= 1--      0.5221                 0.5050                 0.5821
 Alpha2 Fr= 1--      0.0404                 0.0225                 0.0026
 Beta2  Fr= 1--      0.4050                 0.2076                 0.0347
 AlphaG Fr= 1--      0.0086                 0.0250                 0.0010
 Gamma2 Fr= 1--      2.4194                -3.9651                 0.0648
 Delta2 Fr= 1--     -1.0862                -0.0080                -0.0275
 Raman1 Fr= 1--      18.618                  9.863                  1.432
 ROA1   Fr= 1--     197.503               -380.904                  5.343
 CID1   Fr= 1--      10.608                -38.619                  3.730
 Raman2 Fr= 1--       4.860                  2.491                  0.417
 ROA2   Fr= 1--      66.755                -95.098                  1.776
 CID2   Fr= 1--      13.734                -38.182                  4.261
 Raman3 Fr= 1--       9.721                  4.981                  0.834
 ROA3   Fr= 1--     197.503               -380.904                  5.343
 CID3   Fr= 1--      20.317                -76.467                  6.408
 RC180  Fr= 1--       0.044                  0.010                  0.164
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03   0.04  -0.05    -0.02  -0.04  -0.07    -0.00   0.01   0.01
     2   6     0.02   0.04  -0.09    -0.02  -0.04  -0.07     0.00   0.00   0.00
     3   6     0.02  -0.00  -0.02    -0.03  -0.02  -0.15    -0.00   0.01   0.01
     4   6    -0.02  -0.02   0.06     0.02   0.02  -0.04     0.00   0.01   0.00
     5   6    -0.02   0.01   0.16     0.04   0.05   0.16     0.01   0.01  -0.00
     6   6    -0.02   0.04   0.05     0.03   0.01   0.10     0.01   0.01   0.00
     7   6     0.04   0.06   0.02    -0.02  -0.01   0.12    -0.01   0.00  -0.00
     8   1     0.07  -0.03  -0.06    -0.06  -0.02  -0.24    -0.00   0.01   0.01
     9   1    -0.03   0.02   0.28     0.06   0.09   0.34     0.01   0.01  -0.00
    10   1    -0.07   0.07   0.09     0.07   0.01   0.21     0.01   0.00  -0.00
    11   6    -0.04  -0.04   0.01     0.03   0.02  -0.03     0.00   0.02  -0.01
    12   6    -0.16  -0.00  -0.02     0.11  -0.01  -0.01    -0.02  -0.03  -0.03
    13   6    -0.05  -0.03  -0.00     0.03   0.01  -0.01     0.01   0.01  -0.00
    14   1    -0.01  -0.04  -0.03     0.00   0.02  -0.01     0.02   0.03   0.01
    15   1    -0.22  -0.01   0.02     0.16  -0.00  -0.05    -0.51  -0.28  -0.25
    16   1    -0.16   0.03  -0.12     0.12  -0.03   0.07    -0.01   0.51   0.06
    17   1    -0.19  -0.00   0.00     0.15  -0.01  -0.02     0.42  -0.37   0.10
    18   8    -0.06  -0.02  -0.00     0.03   0.01   0.01     0.02   0.00   0.03
    19   8    -0.08  -0.01  -0.02     0.02  -0.02  -0.01     0.00  -0.03   0.00
    20   1    -0.08  -0.02  -0.03     0.02  -0.02  -0.03    -0.00  -0.01  -0.02
    21   6     0.04   0.07   0.05    -0.01  -0.01   0.20    -0.01  -0.00  -0.01
    22   6     0.04   0.05  -0.05    -0.03  -0.04  -0.03    -0.00  -0.00  -0.00
    23   6     0.03   0.04  -0.17    -0.04  -0.07  -0.15    -0.00  -0.00  -0.01
    24   8     0.04  -0.03   0.04    -0.03   0.01  -0.08    -0.00   0.00   0.01
    25   6     0.20  -0.14   0.02    -0.13   0.09   0.03    -0.01   0.01  -0.00
    26   1     0.05   0.07   0.08    -0.02   0.01   0.24    -0.01   0.00  -0.01
    27   1     0.05   0.09   0.15    -0.00   0.03   0.39    -0.01  -0.01  -0.02
    28   1     0.04   0.02  -0.24    -0.05  -0.09  -0.25     0.00  -0.00  -0.01
    29   1     0.43  -0.24  -0.09    -0.06   0.09   0.01     0.01  -0.03  -0.02
    30   1     0.18  -0.24   0.27    -0.09   0.21   0.14    -0.01   0.02   0.04
    31   1     0.12  -0.02  -0.11    -0.30   0.06   0.03    -0.05   0.03  -0.03
                     10                     11                     12
                      A                      A                      A
 Frequencies --    231.0049               259.1101               286.9122
 Red. masses --      1.4984                 2.4925                 2.7928
 Frc consts  --      0.0471                 0.0986                 0.1355
 IR Inten    --      2.2999                 8.1307                 0.1718
 RamAct Fr= 1--      1.6722                 0.7370                 1.3145
  Dep-P Fr= 1--      0.6935                 0.7465                 0.5491
  Dep-U Fr= 1--      0.8190                 0.8548                 0.7090
 Alpha2 Fr= 1--      0.0017                 0.0000                 0.0051
 Beta2  Fr= 1--      0.2283                 0.1050                 0.1553
 AlphaG Fr= 1--     -0.0005                 0.0004                -0.0033
 Gamma2 Fr= 1--      0.4966                -0.8982                 0.6878
 Delta2 Fr= 1--      0.0329                 0.3084                -0.0747
 Raman1 Fr= 1--       6.689                  2.948                  5.258
 ROA1   Fr= 1--      48.728                -76.359                 63.643
 CID1   Fr= 1--       7.285                -25.901                 12.104
 Raman2 Fr= 1--       2.739                  1.260                  1.864
 ROA2   Fr= 1--      11.655                -24.024                 17.106
 CID2   Fr= 1--       4.255                -19.066                  9.177
 Raman3 Fr= 1--       5.478                  2.520                  3.728
 ROA3   Fr= 1--      48.728                -76.359                 63.643
 CID3   Fr= 1--       8.895                -30.300                 17.072
 RC180  Fr= 1--       0.638                  0.710                  0.418
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01   0.02   0.08    -0.02  -0.02   0.00     0.00   0.02   0.08
     2   6     0.01   0.01   0.04    -0.04   0.01   0.05    -0.02   0.00  -0.04
     3   6     0.01   0.03   0.08    -0.02  -0.07  -0.05     0.01   0.01   0.14
     4   6     0.01   0.02  -0.00    -0.03  -0.08  -0.04     0.01  -0.02   0.02
     5   6     0.02   0.02  -0.00    -0.07  -0.06  -0.03    -0.02   0.00   0.08
     6   6     0.02   0.01   0.04    -0.07  -0.01   0.02    -0.02   0.02   0.05
     7   6    -0.01  -0.00   0.01     0.00   0.00   0.01    -0.01   0.01   0.01
     8   1     0.00   0.04   0.11    -0.00  -0.08  -0.07     0.02   0.02   0.20
     9   1     0.03   0.02  -0.04    -0.10  -0.09  -0.05    -0.03  -0.01   0.11
    10   1     0.04   0.01   0.04    -0.09   0.00   0.03    -0.03   0.02   0.07
    11   6     0.01   0.00  -0.03    -0.01  -0.04   0.02     0.02  -0.04  -0.04
    12   6     0.04  -0.03  -0.03     0.14   0.12   0.09     0.17   0.07   0.02
    13   6    -0.01  -0.01  -0.02     0.00  -0.02   0.01    -0.00  -0.04  -0.04
    14   1    -0.01  -0.00  -0.02     0.01  -0.04  -0.02     0.01  -0.05  -0.07
    15   1     0.14   0.01  -0.02     0.03   0.09   0.11     0.15   0.07   0.04
    16   1     0.04  -0.14  -0.02     0.15   0.32   0.26     0.18   0.17   0.20
    17   1    -0.03   0.02  -0.04     0.37   0.10  -0.04     0.34   0.08  -0.10
    18   8    -0.01   0.01   0.02    -0.01  -0.03  -0.09    -0.03  -0.01  -0.06
    19   8    -0.05  -0.03  -0.04     0.08   0.06   0.03    -0.03  -0.01  -0.07
    20   1    -0.05  -0.03  -0.07     0.09   0.04   0.12    -0.02  -0.05  -0.08
    21   6    -0.01  -0.03  -0.07    -0.00   0.04   0.01    -0.02  -0.00  -0.09
    22   6    -0.00  -0.02  -0.04    -0.03   0.05  -0.00    -0.03   0.01  -0.06
    23   6     0.00  -0.02  -0.02    -0.04   0.05   0.05    -0.03  -0.01  -0.15
    24   8     0.00   0.00   0.03    -0.03   0.00  -0.06    -0.02   0.02   0.14
    25   6    -0.04   0.02  -0.01     0.08  -0.06   0.00    -0.00  -0.02   0.01
    26   1    -0.02  -0.00  -0.01     0.03  -0.01   0.01    -0.01   0.01   0.03
    27   1    -0.02  -0.05  -0.14     0.03   0.06   0.01    -0.01  -0.00  -0.13
    28   1     0.01  -0.03  -0.06    -0.06   0.06   0.03    -0.03  -0.01  -0.16
    29   1     0.29  -0.30  -0.25     0.39  -0.20  -0.15    -0.30   0.13   0.16
    30   1     0.01   0.15   0.51     0.07  -0.09   0.38    -0.04  -0.12  -0.40
    31   1    -0.45   0.24  -0.29    -0.15   0.07  -0.16     0.35  -0.10   0.16
                     13                     14                     15
                      A                      A                      A
 Frequencies --    331.7930               358.9141               400.9435
 Red. masses --      4.5733                 5.4237                 5.1285
 Frc consts  --      0.2966                 0.4117                 0.4857
 IR Inten    --      4.6755                 4.2088                 0.5973
 RamAct Fr= 1--      0.7568                13.4366                 0.9818
  Dep-P Fr= 1--      0.1531                 0.1672                 0.5005
  Dep-U Fr= 1--      0.2655                 0.2865                 0.6672
 Alpha2 Fr= 1--      0.0116                 0.1988                 0.0048
 Beta2  Fr= 1--      0.0335                 0.6415                 0.1092
 AlphaG Fr= 1--      0.0338                -0.0818                 0.0313
 Gamma2 Fr= 1--      1.0220                -3.1347                -1.7938
 Delta2 Fr= 1--      0.1778                -0.3408                -0.3282
 Raman1 Fr= 1--       3.027                 53.746                  3.927
 ROA1   Fr= 1--     103.804               -311.833               -182.706
 CID1   Fr= 1--      34.290                 -5.802                -46.521
 Raman2 Fr= 1--       0.402                  7.698                  1.310
 ROA2   Fr= 1--      23.107                -72.505                -40.425
 CID2   Fr= 1--      57.494                 -9.419                -30.857
 Raman3 Fr= 1--       0.804                 15.396                  2.620
 ROA3   Fr= 1--     103.804               -311.833               -182.706
 CID3   Fr= 1--     129.142                -20.254                -69.731
 RC180  Fr= 1--      -0.469                 -0.427                  0.334
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.09  -0.12   0.05    -0.09  -0.07   0.06    -0.05  -0.06  -0.11
     2   6    -0.12  -0.10   0.03    -0.01  -0.13   0.04    -0.03  -0.07  -0.08
     3   6    -0.10  -0.08   0.03    -0.15   0.10  -0.02    -0.04   0.07   0.18
     4   6    -0.01  -0.02  -0.01    -0.11   0.15  -0.08     0.01   0.11   0.20
     5   6    -0.03  -0.03   0.01     0.04   0.10  -0.04     0.03   0.08   0.11
     6   6    -0.05  -0.08   0.03     0.07  -0.07   0.06     0.02  -0.04  -0.12
     7   6     0.00  -0.07   0.02     0.00  -0.04   0.04    -0.03  -0.06  -0.19
     8   1    -0.17  -0.04   0.03    -0.25   0.16  -0.02    -0.10   0.12   0.26
     9   1    -0.03  -0.04   0.01     0.18   0.18  -0.07     0.07   0.11   0.12
    10   1     0.01  -0.11   0.05     0.17  -0.12   0.10     0.07  -0.09  -0.22
    11   6     0.04   0.12  -0.07    -0.18   0.12  -0.01     0.01  -0.01   0.02
    12   6     0.03  -0.07  -0.12     0.02  -0.01   0.04     0.07   0.03   0.06
    13   6     0.08   0.12  -0.02    -0.14   0.01   0.01     0.03  -0.05  -0.06
    14   1     0.09   0.16  -0.01    -0.26   0.11   0.05    -0.05  -0.04   0.01
    15   1     0.21  -0.05  -0.23     0.08  -0.05  -0.13     0.07   0.04   0.08
    16   1     0.03  -0.29  -0.15     0.03  -0.03   0.22     0.08   0.10   0.19
    17   1    -0.12  -0.08  -0.02     0.12  -0.09   0.07     0.19   0.04  -0.02
    18   8     0.14   0.11   0.17    -0.09  -0.15  -0.10     0.01   0.00  -0.07
    19   8     0.03  -0.05  -0.03     0.03   0.01   0.10    -0.10  -0.09  -0.15
    20   1     0.01  -0.00  -0.15    -0.03   0.13   0.19    -0.07  -0.15  -0.27
    21   6     0.00   0.06  -0.03     0.04  -0.04  -0.03     0.00   0.03   0.16
    22   6    -0.05   0.10  -0.03     0.12  -0.05  -0.04     0.02   0.03   0.17
    23   6    -0.13   0.03  -0.02     0.01  -0.12  -0.03    -0.02  -0.01   0.12
    24   8    -0.05   0.10   0.00     0.16   0.08   0.01     0.01   0.03  -0.13
    25   6     0.17  -0.04  -0.00     0.18   0.10  -0.03     0.07   0.02  -0.02
    26   1     0.11  -0.12   0.04     0.08  -0.08   0.06    -0.02  -0.11  -0.35
    27   1     0.07   0.11  -0.05    -0.02  -0.08  -0.03     0.00   0.03   0.21
    28   1    -0.21   0.08  -0.03    -0.05  -0.09  -0.04    -0.05  -0.01   0.07
    29   1     0.28   0.01  -0.01     0.15   0.10  -0.01     0.22   0.05  -0.05
    30   1     0.11  -0.27   0.00     0.17   0.06  -0.08     0.06  -0.02   0.12
    31   1     0.33   0.00  -0.01     0.25   0.10  -0.02    -0.00   0.01  -0.03
                     16                     17                     18
                      A                      A                      A
 Frequencies --    414.5702               465.6080               481.8818
 Red. masses --      3.2747                 4.0224                 4.9630
 Frc consts  --      0.3316                 0.5138                 0.6790
 IR Inten    --      0.3533                21.5460                 4.0466
 RamAct Fr= 1--      4.6170                 0.7706                 3.7159
  Dep-P Fr= 1--      0.7500                 0.5799                 0.1746
  Dep-U Fr= 1--      0.8571                 0.7341                 0.2973
 Alpha2 Fr= 1--      0.0000                 0.0025                 0.0539
 Beta2  Fr= 1--      0.6596                 0.0943                 0.1841
 AlphaG Fr= 1--     -0.0001                 0.0243                 0.0148
 Gamma2 Fr= 1--      0.4740                -0.8682                 0.8053
 Delta2 Fr= 1--     -0.4912                -0.0599                -0.2050
 Raman1 Fr= 1--      18.468                  3.082                 14.863
 ROA1   Fr= 1--      29.783                -85.261                 70.753
 CID1   Fr= 1--       1.613                -27.662                  4.760
 Raman2 Fr= 1--       7.915                  1.131                  2.209
 ROA2   Fr= 1--      15.304                -20.357                 20.968
 CID2   Fr= 1--       1.934                -17.994                  9.491
 Raman3 Fr= 1--      15.830                  2.263                  4.419
 ROA3   Fr= 1--      29.783                -85.261                 70.753
 CID3   Fr= 1--       1.881                -37.682                 16.013
 RC180  Fr= 1--       0.714                  0.468                 -0.405
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01  -0.00  -0.06    -0.00   0.08  -0.01    -0.06   0.09  -0.01
     2   6     0.01   0.02   0.05     0.03   0.05  -0.06    -0.04   0.08   0.05
     3   6     0.02   0.01   0.13    -0.03  -0.06   0.07    -0.06   0.00  -0.06
     4   6    -0.01  -0.03  -0.06    -0.10  -0.10   0.06    -0.07  -0.03   0.00
     5   6    -0.02  -0.05  -0.17    -0.10  -0.12   0.12    -0.15  -0.01  -0.07
     6   6     0.01   0.04   0.21    -0.11  -0.02  -0.06    -0.13   0.08   0.06
     7   6    -0.01  -0.03  -0.20     0.01   0.09  -0.05    -0.07   0.08   0.01
     8   1     0.05   0.04   0.35     0.09  -0.13   0.05    -0.02  -0.02  -0.07
     9   1    -0.04  -0.08  -0.33    -0.13  -0.13   0.20    -0.22  -0.07  -0.14
    10   1     0.01   0.09   0.41    -0.26   0.05  -0.11    -0.21   0.12   0.06
    11   6    -0.01   0.01  -0.02    -0.11   0.16  -0.09     0.01  -0.09   0.07
    12   6    -0.01  -0.01  -0.03     0.09   0.00  -0.10    -0.03   0.01   0.12
    13   6    -0.02   0.01   0.02    -0.08   0.13  -0.05     0.14  -0.01  -0.03
    14   1     0.01   0.02  -0.01     0.04   0.23  -0.03    -0.05  -0.10   0.07
    15   1    -0.01  -0.02  -0.04     0.29  -0.00  -0.30    -0.08   0.05   0.26
    16   1    -0.01  -0.03  -0.05     0.10  -0.15   0.13    -0.03   0.09   0.10
    17   1    -0.04  -0.02  -0.00     0.14  -0.05  -0.07    -0.01   0.09   0.01
    18   8    -0.00  -0.01   0.02     0.03  -0.03   0.04     0.10   0.12   0.06
    19   8     0.03   0.03   0.04     0.06  -0.04   0.05    -0.01  -0.03  -0.14
    20   1     0.03   0.03   0.09    -0.11   0.29  -0.05     0.11  -0.25  -0.21
    21   6     0.01   0.03   0.16     0.02   0.02   0.01    -0.04  -0.12   0.02
    22   6     0.00   0.01   0.05     0.10  -0.03   0.06     0.08  -0.16  -0.02
    23   6    -0.00  -0.02  -0.14     0.08  -0.00   0.03     0.00  -0.17  -0.01
    24   8    -0.00  -0.02  -0.02     0.11  -0.11  -0.02     0.16   0.02   0.01
    25   6    -0.02  -0.01   0.00    -0.06   0.01   0.00     0.12   0.11  -0.03
    26   1    -0.03  -0.06  -0.38    -0.01   0.09  -0.11    -0.16   0.14   0.04
    27   1     0.02   0.05   0.27    -0.06  -0.04  -0.01    -0.22  -0.24   0.09
    28   1    -0.01  -0.06  -0.35     0.09  -0.01   0.02     0.09  -0.21  -0.02
    29   1    -0.04   0.03   0.03    -0.16  -0.03   0.01     0.08   0.09  -0.02
    30   1    -0.02   0.00  -0.03     0.00   0.21  -0.01     0.13   0.13  -0.06
    31   1    -0.01  -0.04   0.04    -0.20  -0.04   0.01     0.12   0.10  -0.02
                     19                     20                     21
                      A                      A                      A
 Frequencies --    486.1414               509.7037               533.8700
 Red. masses --      2.5453                 3.9595                 3.2844
 Frc consts  --      0.3544                 0.6061                 0.5515
 IR Inten    --     15.4270                13.0543                 9.8064
 RamAct Fr= 1--      0.1538                 4.1824                 3.4369
  Dep-P Fr= 1--      0.5959                 0.6501                 0.6798
  Dep-U Fr= 1--      0.7468                 0.7880                 0.8094
 Alpha2 Fr= 1--      0.0004                 0.0075                 0.0043
 Beta2  Fr= 1--      0.0191                 0.5493                 0.4636
 AlphaG Fr= 1--      0.0008                 0.0438                 0.0599
 Gamma2 Fr= 1--     -0.4039                 0.4612                -1.7814
 Delta2 Fr= 1--      0.0189                 0.9680                -0.1108
 Raman1 Fr= 1--       0.615                 16.730                 13.748
 ROA1   Fr= 1--     -38.172                 75.248               -174.559
 CID1   Fr= 1--     -62.041                  4.498                -12.697
 Raman2 Fr= 1--       0.230                  6.591                  5.564
 ROA2   Fr= 1--      -9.845                  3.323                -41.867
 CID2   Fr= 1--     -42.853                  0.504                 -7.525
 Raman3 Fr= 1--       0.459                 13.182                 11.127
 ROA3   Fr= 1--     -38.172                 75.248               -174.559
 CID3   Fr= 1--     -83.077                  5.708                -15.687
 RC180  Fr= 1--       0.494                  0.576                  0.619
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02   0.03   0.21    -0.03  -0.04  -0.02     0.03  -0.08   0.02
     2   6     0.01   0.03   0.18     0.04  -0.04   0.07    -0.07  -0.03   0.01
     3   6    -0.01  -0.02  -0.11    -0.05  -0.01  -0.06    -0.01   0.08  -0.01
     4   6     0.01   0.01   0.03    -0.04   0.02   0.03    -0.04   0.09  -0.02
     5   6     0.01   0.01   0.05     0.03  -0.05  -0.09    -0.13   0.14   0.00
     6   6     0.00  -0.02  -0.10     0.05  -0.07   0.08    -0.12  -0.00  -0.00
     7   6    -0.01  -0.02  -0.10     0.04   0.02   0.02     0.16  -0.06  -0.01
     8   1    -0.03  -0.08  -0.44    -0.07  -0.01  -0.08    -0.11   0.13   0.01
     9   1     0.01   0.00  -0.03     0.09  -0.03  -0.20    -0.11   0.15   0.00
    10   1    -0.01  -0.08  -0.41     0.06  -0.08   0.09    -0.06  -0.04  -0.02
    11   6     0.00  -0.00   0.00    -0.05   0.09   0.12    -0.03  -0.04  -0.03
    12   6    -0.00  -0.00   0.01    -0.05   0.01   0.20     0.00  -0.00  -0.03
    13   6     0.00  -0.00   0.00     0.02   0.10  -0.06     0.04  -0.05   0.01
    14   1    -0.00  -0.01   0.00    -0.03   0.14   0.25    -0.13  -0.09  -0.09
    15   1     0.00   0.00   0.01    -0.02   0.02   0.20     0.00   0.00  -0.02
    16   1    -0.00   0.00   0.00    -0.05   0.01   0.24     0.01   0.02   0.01
    17   1    -0.00   0.00   0.00    -0.04   0.03   0.18     0.04   0.00  -0.06
    18   8    -0.00   0.00  -0.00     0.08   0.00  -0.06     0.00   0.03   0.05
    19   8    -0.00  -0.01   0.00    -0.05  -0.15  -0.10     0.00   0.07  -0.03
    20   1    -0.03   0.06  -0.02    -0.19   0.13  -0.44     0.30  -0.51   0.25
    21   6     0.00   0.01   0.05     0.03   0.14  -0.03     0.16   0.02  -0.01
    22   6     0.00   0.02   0.07     0.04   0.08  -0.09     0.06   0.04   0.00
    23   6    -0.01  -0.02  -0.12     0.04   0.09  -0.05    -0.03   0.02   0.00
    24   8    -0.01   0.00  -0.01     0.02  -0.10   0.04     0.06  -0.12   0.01
    25   6    -0.00  -0.00   0.00    -0.10  -0.06   0.02    -0.09  -0.07   0.02
    26   1    -0.03  -0.09  -0.45     0.16  -0.02   0.10     0.26  -0.12  -0.03
    27   1    -0.00  -0.01  -0.12     0.09   0.19   0.03     0.25   0.07  -0.05
    28   1    -0.04  -0.08  -0.49    -0.07   0.15  -0.03    -0.11   0.05  -0.02
    29   1    -0.01   0.03   0.02    -0.22  -0.09   0.04    -0.20  -0.10   0.04
    30   1    -0.01  -0.02  -0.04    -0.06   0.10  -0.03    -0.04   0.12  -0.02
    31   1     0.02  -0.02   0.03    -0.18  -0.08   0.03    -0.21  -0.10   0.03
                     22                     23                     24
                      A                      A                      A
 Frequencies --    540.3178               578.2447               604.1917
 Red. masses --      2.9527                 1.7093                 2.7736
 Frc consts  --      0.5079                 0.3367                 0.5965
 IR Inten    --     11.6925                42.3043                 2.1626
 RamAct Fr= 1--     17.9605                 1.7478                 3.0807
  Dep-P Fr= 1--      0.2413                 0.2546                 0.5017
  Dep-U Fr= 1--      0.3888                 0.4058                 0.6682
 Alpha2 Fr= 1--      0.2181                 0.0205                 0.0151
 Beta2  Fr= 1--      1.1638                 0.1182                 0.3431
 AlphaG Fr= 1--     -0.5263                 0.2229                -0.0292
 Gamma2 Fr= 1--      2.5055                 1.5063                -0.4296
 Delta2 Fr= 1--      0.3833                 0.1997                 0.0591
 Raman1 Fr= 1--      71.842                  6.991                 12.323
 ROA1   Fr= 1--     252.795                150.997                -39.350
 CID1   Fr= 1--       3.519                 21.598                 -3.193
 Raman2 Fr= 1--      13.965                  1.419                  4.117
 ROA2   Fr= 1--      57.066                 34.554                -10.783
 CID2   Fr= 1--       4.086                 24.359                 -2.619
 Raman3 Fr= 1--      27.930                  2.837                  8.234
 ROA3   Fr= 1--     252.795                150.997                -39.350
 CID3   Fr= 1--       9.051                 53.224                 -4.779
 RC180  Fr= 1--      -0.222                 -0.188                  0.336
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.11  -0.03  -0.01    -0.05  -0.01   0.01     0.02   0.02   0.09
     2   6    -0.05   0.06  -0.00    -0.03  -0.04  -0.02     0.01  -0.03  -0.16
     3   6     0.10   0.03  -0.01    -0.04   0.02   0.02     0.01   0.01   0.00
     4   6     0.03   0.02  -0.00     0.00   0.02  -0.04    -0.03  -0.03  -0.19
     5   6    -0.09   0.08  -0.02    -0.01   0.03  -0.00     0.01  -0.01   0.01
     6   6    -0.09   0.09  -0.00    -0.00  -0.02   0.00     0.01  -0.01  -0.00
     7   6     0.12  -0.09   0.01    -0.02   0.02  -0.00     0.00  -0.00   0.06
     8   1     0.08   0.04  -0.03    -0.08   0.04   0.02     0.04   0.04   0.21
     9   1    -0.15   0.05  -0.01     0.01   0.06   0.06     0.05   0.07   0.38
    10   1    -0.08   0.09   0.02     0.04  -0.03   0.06     0.02   0.06   0.36
    11   6     0.00   0.06   0.03     0.04  -0.12  -0.02    -0.02   0.00   0.03
    12   6    -0.01   0.01   0.03     0.00  -0.01  -0.03    -0.04  -0.00   0.09
    13   6    -0.04   0.08  -0.02     0.05  -0.08   0.03     0.00   0.05  -0.02
    14   1     0.06   0.10   0.11    -0.05  -0.16  -0.06    -0.03   0.02   0.11
    15   1     0.01   0.01   0.01    -0.07   0.01   0.09    -0.08   0.00   0.14
    16   1    -0.01  -0.01   0.03     0.00   0.06  -0.09    -0.05   0.02   0.04
    17   1    -0.02  -0.00   0.06     0.01   0.04  -0.09    -0.07   0.02   0.07
    18   8     0.01  -0.02  -0.05    -0.04   0.06   0.03     0.04   0.01   0.01
    19   8     0.00  -0.09   0.03     0.05  -0.00   0.03     0.01  -0.02  -0.03
    20   1    -0.37   0.64  -0.33    -0.36   0.80  -0.24     0.06  -0.12  -0.02
    21   6     0.12  -0.15   0.02    -0.02   0.06  -0.01    -0.01  -0.02  -0.05
    22   6    -0.06  -0.05   0.00     0.04   0.03   0.02     0.01   0.04   0.24
    23   6    -0.06  -0.05   0.01    -0.01   0.00   0.00     0.01   0.00  -0.02
    24   8    -0.07   0.05  -0.00     0.06  -0.05  -0.00    -0.02   0.00  -0.05
    25   6     0.01  -0.02   0.00    -0.01  -0.00  -0.00    -0.00  -0.00  -0.00
    26   1     0.06  -0.06   0.03     0.03  -0.01  -0.03    -0.03  -0.05  -0.25
    27   1     0.19  -0.10   0.02    -0.04   0.04  -0.05    -0.03  -0.10  -0.53
    28   1     0.04  -0.10   0.03    -0.07   0.04  -0.01     0.01  -0.05  -0.26
    29   1     0.08   0.00  -0.01    -0.06  -0.02   0.01     0.04   0.03  -0.00
    30   1    -0.02  -0.13   0.02     0.02   0.09  -0.01    -0.01  -0.02   0.02
    31   1     0.08   0.01  -0.01    -0.07  -0.02   0.01    -0.01  -0.02   0.01
                     25                     26                     27
                      A                      A                      A
 Frequencies --    636.0611               688.6525               694.7396
 Red. masses --      5.3781                 5.2760                 3.7411
 Frc consts  --      1.2820                 1.4742                 1.0639
 IR Inten    --      2.4628                 4.1390                10.8455
 RamAct Fr= 1--      0.9314                 2.4323                 0.3362
  Dep-P Fr= 1--      0.6193                 0.1699                 0.3046
  Dep-U Fr= 1--      0.7649                 0.2904                 0.4669
 Alpha2 Fr= 1--      0.0022                 0.0357                 0.0034
 Beta2  Fr= 1--      0.1187                 0.1177                 0.0262
 AlphaG Fr= 1--      0.0245                -0.1326                -0.0138
 Gamma2 Fr= 1--      0.5846                -1.0240                -0.0706
 Delta2 Fr= 1--      0.2443                -0.0979                 0.0703
 Raman1 Fr= 1--       3.726                  9.729                  1.345
 ROA1   Fr= 1--      63.940               -101.440                 -4.525
 CID1   Fr= 1--      17.162                -10.426                 -3.365
 Raman2 Fr= 1--       1.425                  1.413                  0.314
 ROA2   Fr= 1--      12.076                -23.793                 -2.255
 CID2   Fr= 1--       8.475                -16.843                 -7.185
 Raman3 Fr= 1--       2.850                  2.825                  0.628
 ROA3   Fr= 1--      63.940               -101.440                 -4.525
 CID3   Fr= 1--      22.437                -35.904                 -7.207
 RC180  Fr= 1--       0.530                 -0.419                 -0.066
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.12  -0.01   0.02    -0.06   0.05   0.06    -0.03   0.01  -0.11
     2   6    -0.18   0.03  -0.01    -0.05   0.04   0.02    -0.01   0.01  -0.03
     3   6    -0.10  -0.17   0.02    -0.09  -0.09   0.08    -0.06  -0.05  -0.05
     4   6     0.15  -0.05  -0.01    -0.03  -0.06  -0.16    -0.01   0.03   0.25
     5   6     0.06   0.06  -0.03     0.16  -0.01   0.06     0.06  -0.04  -0.08
     6   6     0.03   0.21  -0.03     0.14   0.12  -0.11     0.08   0.07   0.09
     7   6     0.04   0.13  -0.00     0.13   0.14  -0.13     0.09   0.10   0.10
     8   1    -0.18  -0.12   0.06    -0.08  -0.08   0.17    -0.05  -0.10  -0.24
     9   1    -0.13  -0.05   0.05     0.14   0.01   0.28     0.04  -0.11  -0.46
    10   1     0.11   0.18   0.03     0.17   0.12  -0.07     0.07   0.05  -0.01
    11   6     0.20   0.08   0.06    -0.12  -0.06  -0.03    -0.08  -0.00  -0.03
    12   6     0.03   0.01  -0.03    -0.06  -0.02   0.11     0.00   0.00  -0.03
    13   6    -0.00   0.05   0.08    -0.07   0.00  -0.11    -0.01  -0.07  -0.03
    14   1     0.29   0.11   0.08    -0.15  -0.04   0.06    -0.10  -0.03  -0.11
    15   1    -0.10  -0.05  -0.06    -0.02   0.03   0.21     0.13   0.02  -0.10
    16   1     0.01  -0.02  -0.34    -0.05   0.02   0.24     0.02  -0.03   0.20
    17   1    -0.17  -0.07   0.18     0.03   0.07  -0.05     0.13  -0.01  -0.09
    18   8     0.01  -0.08  -0.16    -0.03   0.02   0.14    -0.05   0.02   0.06
    19   8    -0.12  -0.03   0.09     0.12   0.01  -0.10     0.05   0.02  -0.05
    20   1    -0.01  -0.25  -0.03     0.08   0.10   0.14    -0.00   0.13   0.06
    21   6     0.05   0.06  -0.03     0.15  -0.00   0.06     0.07  -0.03  -0.10
    22   6     0.06  -0.00   0.05    -0.02  -0.06  -0.14     0.00   0.02   0.20
    23   6    -0.16  -0.10   0.02    -0.10  -0.09   0.07    -0.04  -0.06  -0.05
    24   8     0.10  -0.09  -0.00    -0.07   0.04   0.02    -0.05   0.02  -0.03
    25   6     0.00  -0.02   0.00    -0.04  -0.05   0.01    -0.02  -0.03   0.00
    26   1     0.10   0.09  -0.06     0.16   0.13  -0.10     0.09   0.10   0.09
    27   1    -0.05  -0.02  -0.12     0.12   0.02   0.31     0.03  -0.10  -0.40
    28   1    -0.24  -0.07  -0.05    -0.06  -0.07   0.26    -0.03  -0.12  -0.30
    29   1    -0.09  -0.04   0.02     0.01  -0.05   0.00     0.03   0.00   0.00
    30   1     0.04   0.14  -0.03    -0.06  -0.13   0.03    -0.04  -0.09   0.02
    31   1    -0.10  -0.05   0.01     0.03  -0.02  -0.00     0.01  -0.03   0.01
                     28                     29                     30
                      A                      A                      A
 Frequencies --    739.1923               778.3293               785.0927
 Red. masses --      5.4954                 3.5966                 2.7592
 Frc consts  --      1.7691                 1.2837                 1.0020
 IR Inten    --      5.1013                 0.8418                 0.3794
 RamAct Fr= 1--     20.5809                42.5390                16.9933
  Dep-P Fr= 1--      0.0526                 0.0801                 0.0929
  Dep-U Fr= 1--      0.1000                 0.1484                 0.1700
 Alpha2 Fr= 1--      0.4040                 0.7817                 0.3028
 Beta2  Fr= 1--      0.3430                 1.0519                 0.4814
 AlphaG Fr= 1--     -0.2251                 0.1795                -0.1649
 Gamma2 Fr= 1--     -2.8353                 3.1565                -0.5188
 Delta2 Fr= 1--     -0.0533                 0.8032                 0.0722
 Raman1 Fr= 1--      82.324                170.156                 67.973
 ROA1   Fr= 1--    -273.892                328.726                -47.489
 CID1   Fr= 1--      -3.327                  1.932                 -0.699
 Raman2 Fr= 1--       4.116                 12.622                  5.776
 ROA2   Fr= 1--     -67.620                 69.330                -13.028
 CID2   Fr= 1--     -16.428                  5.493                 -2.255
 Raman3 Fr= 1--       8.232                 25.245                 11.553
 ROA3   Fr= 1--    -273.892                328.726                -47.489
 CID3   Fr= 1--     -33.271                 13.021                 -4.111
 RC180  Fr= 1--      -0.800                 -0.703                 -0.660
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01   0.10   0.03    -0.01  -0.05   0.15     0.03   0.07   0.17
     2   6     0.05  -0.03  -0.01     0.01   0.07  -0.15    -0.03  -0.09  -0.18
     3   6    -0.06   0.06  -0.01    -0.07  -0.11  -0.00     0.05   0.05  -0.05
     4   6    -0.12   0.01  -0.05    -0.01  -0.01   0.06     0.03   0.03   0.11
     5   6     0.01  -0.11   0.01     0.03  -0.02  -0.07    -0.02  -0.00  -0.07
     6   6    -0.00  -0.15   0.01     0.05   0.19  -0.01    -0.02  -0.09   0.09
     7   6     0.13   0.19  -0.07    -0.04  -0.19   0.01     0.01   0.09  -0.04
     8   1     0.01   0.03   0.04    -0.11  -0.14  -0.21     0.04  -0.02  -0.39
     9   1     0.14  -0.00   0.15    -0.08  -0.06   0.07     0.03   0.02  -0.12
    10   1    -0.06  -0.09   0.14    -0.01   0.28   0.20     0.03  -0.09   0.20
    11   6    -0.05   0.08   0.00    -0.09   0.08  -0.02     0.05  -0.03   0.01
    12   6     0.01   0.01  -0.05    -0.03   0.01   0.02     0.02  -0.00  -0.02
    13   6     0.24  -0.13   0.20     0.09  -0.12   0.06    -0.06   0.05  -0.04
    14   1    -0.23  -0.08  -0.28    -0.17  -0.02  -0.23     0.12   0.02   0.10
    15   1     0.08  -0.05  -0.28     0.13  -0.02  -0.23    -0.03   0.01   0.07
    16   1     0.01  -0.09   0.01    -0.02  -0.11   0.23     0.02   0.05  -0.09
    17   1     0.02  -0.12   0.09     0.06  -0.10   0.10    -0.01   0.04  -0.05
    18   8     0.06   0.09  -0.15    -0.01   0.04  -0.02    -0.01  -0.03   0.02
    19   8    -0.14   0.01   0.10    -0.02   0.02  -0.02     0.02  -0.01  -0.01
    20   1    -0.13  -0.02  -0.33    -0.02   0.03  -0.07     0.03  -0.03   0.08
    21   6     0.13  -0.03   0.02    -0.01  -0.03   0.08     0.01   0.05   0.09
    22   6    -0.01  -0.05  -0.03    -0.02   0.01  -0.06     0.00  -0.02  -0.06
    23   6     0.01  -0.08   0.03     0.07   0.10  -0.02    -0.05  -0.06   0.00
    24   8    -0.12   0.08  -0.00     0.03  -0.02   0.00    -0.01   0.01  -0.00
    25   6    -0.05  -0.05   0.01     0.02   0.02  -0.00    -0.01  -0.01   0.00
    26   1     0.10   0.19  -0.11    -0.02  -0.26  -0.22    -0.03   0.04  -0.38
    27   1     0.05  -0.07   0.06     0.11   0.02  -0.09    -0.08  -0.04  -0.16
    28   1     0.08  -0.10   0.10     0.16   0.14   0.36    -0.04   0.08   0.61
    29   1     0.05  -0.02  -0.00    -0.01   0.01  -0.00     0.01  -0.01  -0.00
    30   1    -0.10  -0.22   0.05     0.03   0.08  -0.00    -0.01  -0.02   0.03
    31   1     0.06  -0.01  -0.00    -0.02   0.02  -0.01     0.00   0.00  -0.01
                     31                     32                     33
                      A                      A                      A
 Frequencies --    820.4058               833.7445               840.2338
 Red. masses --      1.4953                 1.6597                 2.6882
 Frc consts  --      0.5930                 0.6797                 1.1182
 IR Inten    --      9.0106                12.6070                11.6499
 RamAct Fr= 1--      1.0569                 0.2426                 2.6398
  Dep-P Fr= 1--      0.3386                 0.7409                 0.7430
  Dep-U Fr= 1--      0.5059                 0.8511                 0.8526
 Alpha2 Fr= 1--      0.0096                 0.0000                 0.0003
 Beta2  Fr= 1--      0.0891                 0.0344                 0.3751
 AlphaG Fr= 1--     -0.0644                -0.0054                 0.0011
 Gamma2 Fr= 1--     -0.2726                 0.2095                 1.5864
 Delta2 Fr= 1--     -0.2529                -0.1373                 0.8779
 Raman1 Fr= 1--       4.228                  0.970                 10.559
 ROA1   Fr= 1--     -34.266                 15.718                180.386
 CID1   Fr= 1--      -8.105                 16.199                 17.083
 Raman2 Fr= 1--       1.069                  0.413                  4.501
 ROA2   Fr= 1--      -4.520                  6.126                 31.050
 CID2   Fr= 1--      -4.227                 14.837                  6.898
 Raman3 Fr= 1--       2.139                  0.826                  9.002
 ROA3   Fr= 1--     -34.266                 15.718                180.386
 CID3   Fr= 1--     -16.022                 19.032                 20.038
 RC180  Fr= 1--       0.012                  0.702                  0.705
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01   0.01   0.02    -0.00   0.01   0.10     0.05   0.02   0.02
     2   6    -0.01  -0.01   0.03     0.01  -0.01  -0.07    -0.05  -0.03  -0.01
     3   6     0.03   0.01  -0.02    -0.02   0.00   0.03     0.11   0.02   0.00
     4   6     0.02   0.01   0.08    -0.01   0.00  -0.00     0.04  -0.02  -0.08
     5   6    -0.01  -0.02  -0.09     0.00   0.00  -0.02    -0.00  -0.01   0.04
     6   6    -0.02  -0.04  -0.08     0.01   0.02   0.02    -0.03  -0.04   0.05
     7   6    -0.01   0.01  -0.02    -0.00  -0.03  -0.10    -0.02   0.02  -0.04
     8   1     0.04  -0.01  -0.09    -0.06  -0.07  -0.37     0.18  -0.02  -0.02
     9   1     0.03   0.09   0.50     0.00  -0.00  -0.05    -0.02  -0.05  -0.17
    10   1     0.05   0.08   0.62     0.00   0.02   0.01    -0.01  -0.12  -0.29
    11   6     0.02   0.04   0.02    -0.01  -0.05  -0.01     0.02   0.17   0.01
    12   6     0.00   0.01  -0.00    -0.00  -0.01  -0.01    -0.02   0.05   0.09
    13   6    -0.01  -0.04  -0.01    -0.00   0.05  -0.00     0.02  -0.15   0.02
    14   1     0.05   0.03  -0.05    -0.02  -0.03   0.05     0.05   0.10  -0.21
    15   1     0.03  -0.01  -0.10    -0.02   0.02   0.09     0.05  -0.08  -0.31
    16   1     0.00  -0.04   0.01     0.00   0.05   0.00    -0.03  -0.18   0.04
    17   1    -0.01  -0.05   0.08     0.03   0.05  -0.11    -0.14  -0.21   0.46
    18   8    -0.04  -0.01   0.02     0.03   0.00  -0.01    -0.08   0.00   0.03
    19   8     0.02   0.00  -0.04    -0.02  -0.00   0.03     0.05   0.02  -0.10
    20   1     0.01   0.02   0.04     0.00  -0.05  -0.02     0.01   0.11   0.03
    21   6    -0.01   0.01  -0.02    -0.00  -0.02  -0.10    -0.04   0.02  -0.04
    22   6    -0.00  -0.01  -0.04     0.01   0.02   0.10    -0.00   0.02   0.07
    23   6    -0.02   0.00   0.07     0.02   0.00  -0.01    -0.09  -0.04  -0.04
    24   8     0.01  -0.00   0.01    -0.01   0.00  -0.02     0.03  -0.03  -0.01
    25   6     0.00   0.00   0.00    -0.00  -0.00  -0.00     0.02   0.01  -0.00
    26   1    -0.01   0.04   0.09     0.05   0.09   0.59    -0.05   0.10   0.23
    27   1    -0.01   0.03   0.17     0.06   0.11   0.62    -0.05   0.05   0.22
    28   1    -0.07  -0.08  -0.45     0.03  -0.00  -0.00    -0.14   0.05   0.25
    29   1    -0.01   0.00   0.00     0.01   0.00  -0.00    -0.01   0.00  -0.00
    30   1     0.00   0.01  -0.02    -0.01  -0.01   0.01     0.03   0.06  -0.00
    31   1     0.00  -0.00   0.00    -0.00  -0.00  -0.00    -0.02  -0.00  -0.00
                     34                     35                     36
                      A                      A                      A
 Frequencies --    866.1396               881.1327               927.3481
 Red. masses --      3.1796                 1.8218                 1.5404
 Frc consts  --      1.4054                 0.8334                 0.7805
 IR Inten    --      5.7850                37.4327                10.5803
 RamAct Fr= 1--     25.5112                 2.2524                 1.1547
  Dep-P Fr= 1--      0.1168                 0.6352                 0.3007
  Dep-U Fr= 1--      0.2092                 0.7769                 0.4624
 Alpha2 Fr= 1--      0.4285                 0.0047                 0.0118
 Beta2  Fr= 1--      0.8897                 0.2917                 0.0890
 AlphaG Fr= 1--      0.2138                 0.0897                 0.0825
 Gamma2 Fr= 1--      0.0041                -0.4507                 0.2764
 Delta2 Fr= 1--     -0.9333                -0.2188                 0.0878
 Raman1 Fr= 1--     102.045                  9.010                  4.619
 ROA1   Fr= 1--     -29.474                -50.267                 29.341
 CID1   Fr= 1--      -0.289                 -5.579                  6.353
 Raman2 Fr= 1--      10.676                  3.500                  1.068
 ROA2   Fr= 1--       7.564                 -9.067                  5.930
 CID2   Fr= 1--       0.708                 -2.591                  5.554
 Raman3 Fr= 1--      21.353                  7.000                  2.136
 ROA3   Fr= 1--     -29.474                -50.267                 29.341
 CID3   Fr= 1--      -1.380                 -7.181                 13.739
 RC180  Fr= 1--      -0.582                  0.554                 -0.075
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.09  -0.01   0.02    -0.00  -0.01  -0.04     0.01   0.02   0.08
     2   6     0.09   0.03  -0.01     0.01   0.02   0.14    -0.01  -0.00  -0.03
     3   6    -0.18  -0.04   0.01     0.01   0.00  -0.00    -0.01  -0.02  -0.17
     4   6    -0.01   0.04  -0.01    -0.00   0.00   0.03    -0.00   0.01   0.07
     5   6    -0.06   0.01   0.00    -0.00  -0.01  -0.06     0.01  -0.02  -0.01
     6   6    -0.05  -0.03   0.01     0.00  -0.01  -0.07     0.01   0.01   0.03
     7   6     0.03   0.01  -0.01    -0.00   0.00   0.01    -0.00  -0.01  -0.01
     8   1    -0.34   0.05   0.07     0.01   0.01   0.07     0.06   0.17   0.88
     9   1    -0.07   0.01   0.03     0.04   0.08   0.44     0.01  -0.01   0.03
    10   1    -0.17   0.03  -0.03     0.03   0.05   0.25    -0.01  -0.01  -0.12
    11   6     0.17   0.06   0.07    -0.01  -0.01   0.00    -0.01  -0.00   0.02
    12   6     0.08   0.02   0.00    -0.00  -0.00  -0.02     0.01  -0.00  -0.03
    13   6    -0.05  -0.06  -0.02    -0.00   0.01  -0.00    -0.00  -0.00  -0.01
    14   1     0.15   0.08   0.16    -0.01  -0.01   0.00    -0.00   0.01   0.05
    15   1    -0.18  -0.06   0.03     0.02   0.01   0.00     0.01   0.01   0.00
    16   1     0.05   0.04  -0.49     0.00   0.01   0.03     0.01   0.01   0.01
    17   1    -0.23  -0.04   0.27     0.03   0.02  -0.06     0.04   0.02  -0.08
    18   8    -0.08  -0.04   0.03     0.01   0.00  -0.00    -0.00  -0.00   0.00
    19   8     0.05  -0.00  -0.08    -0.00  -0.00   0.01     0.00  -0.00   0.00
    20   1     0.02   0.08   0.09     0.00  -0.01  -0.00    -0.01   0.03  -0.00
    21   6     0.05  -0.05  -0.00    -0.00  -0.00  -0.02    -0.00  -0.01  -0.04
    22   6     0.03  -0.03   0.02     0.01   0.02   0.09    -0.00   0.01   0.01
    23   6     0.18   0.04  -0.04    -0.02  -0.03  -0.18    -0.01   0.00   0.01
    24   8    -0.06   0.06  -0.01     0.00  -0.01  -0.02     0.00  -0.01  -0.00
    25   6    -0.04  -0.03   0.01     0.00   0.00  -0.00     0.00   0.00  -0.00
    26   1     0.11  -0.02   0.04     0.00   0.01   0.05    -0.01  -0.02  -0.07
    27   1     0.05  -0.05   0.06     0.00   0.01   0.01     0.04   0.06   0.33
    28   1     0.35  -0.01   0.09     0.04   0.14   0.79    -0.02   0.01   0.01
    29   1     0.04  -0.00  -0.01    -0.00  -0.01  -0.00    -0.00   0.00   0.00
    30   1    -0.08  -0.15   0.04     0.01   0.01   0.03     0.01   0.01  -0.00
    31   1     0.04   0.00   0.00    -0.00   0.00  -0.01    -0.00  -0.00  -0.00
                     37                     38                     39
                      A                      A                      A
 Frequencies --    947.9456               961.4682               969.3010
 Red. masses --      3.5160                 1.3108                 1.3281
 Frc consts  --      1.8615                 0.7139                 0.7352
 IR Inten    --     24.0741                 0.5705                 0.6349
 RamAct Fr= 1--      0.9107                 1.8018                 0.6910
  Dep-P Fr= 1--      0.7451                 0.7341                 0.6623
  Dep-U Fr= 1--      0.8539                 0.8467                 0.7969
 Alpha2 Fr= 1--      0.0001                 0.0005                 0.0011
 Beta2  Fr= 1--      0.1296                 0.2543                 0.0918
 AlphaG Fr= 1--      0.0047                 0.0245                -0.0413
 Gamma2 Fr= 1--      1.3883                 0.2832                -0.6045
 Delta2 Fr= 1--     -1.8612                -0.0980                 0.2224
 Raman1 Fr= 1--       3.643                  7.207                  2.764
 ROA1   Fr= 1--      73.719                 24.047                -50.920
 CID1   Fr= 1--      20.238                  3.336                -18.423
 Raman2 Fr= 1--       1.555                  3.051                  1.101
 ROA2   Fr= 1--      48.208                  7.580                -16.288
 CID2   Fr= 1--      30.996                  2.485                -14.791
 Raman3 Fr= 1--       3.111                  6.102                  2.202
 ROA3   Fr= 1--      73.719                 24.047                -50.920
 CID3   Fr= 1--      23.699                  3.941                -23.120
 RC180  Fr= 1--       0.708                  0.693                  0.594
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02  -0.06   0.02    -0.00  -0.00  -0.01     0.00   0.00   0.03
     2   6     0.06  -0.06   0.01    -0.00  -0.00  -0.01     0.00   0.00   0.01
     3   6     0.03  -0.17   0.00     0.00   0.00   0.01    -0.00  -0.01  -0.05
     4   6     0.11  -0.03   0.00    -0.00   0.00   0.01     0.00   0.00   0.01
     5   6    -0.11   0.23  -0.04    -0.01  -0.02  -0.11     0.00   0.01   0.03
     6   6    -0.04  -0.00   0.01     0.01   0.02   0.11    -0.00  -0.00  -0.03
     7   6    -0.02   0.06  -0.00    -0.00  -0.01  -0.02    -0.01  -0.02  -0.12
     8   1     0.03  -0.14   0.17    -0.00  -0.01  -0.05     0.02   0.04   0.21
     9   1    -0.19   0.19  -0.00     0.04   0.12   0.68    -0.02  -0.03  -0.15
    10   1     0.16  -0.10  -0.02    -0.04  -0.12  -0.64     0.01   0.03   0.16
    11   6    -0.03  -0.02  -0.07    -0.00  -0.00   0.01    -0.00   0.00   0.00
    12   6    -0.08   0.01   0.05     0.00  -0.00  -0.01     0.00   0.00  -0.00
    13   6     0.00   0.02  -0.00    -0.00   0.00  -0.00     0.00  -0.00  -0.00
    14   1     0.08  -0.03  -0.27    -0.00  -0.00  -0.00     0.00   0.00   0.01
    15   1     0.18   0.02  -0.16     0.01   0.00  -0.00     0.00   0.00  -0.00
    16   1    -0.06  -0.14   0.44     0.00   0.00   0.01     0.00  -0.00   0.01
    17   1     0.12  -0.08   0.02     0.01   0.00  -0.02     0.01   0.00  -0.01
    18   8     0.02   0.01  -0.00     0.00  -0.00   0.00    -0.00  -0.00   0.00
    19   8    -0.01   0.00   0.02    -0.00  -0.00   0.00     0.00  -0.00   0.00
    20   1    -0.01   0.00   0.00     0.00  -0.01   0.00    -0.00   0.01  -0.00
    21   6    -0.07   0.15  -0.03     0.00   0.01   0.03     0.00   0.02   0.10
    22   6     0.07  -0.05   0.01    -0.00  -0.00  -0.01     0.00  -0.00  -0.01
    23   6     0.13  -0.11   0.01     0.00   0.00   0.02     0.00  -0.01  -0.01
    24   8    -0.06   0.08  -0.01     0.00   0.00   0.00    -0.00   0.00   0.00
    25   6    -0.06  -0.04   0.01    -0.00  -0.00   0.00    -0.00  -0.00   0.00
    26   1     0.14  -0.03  -0.05     0.01   0.03   0.16     0.06   0.12   0.70
    27   1    -0.20   0.08   0.07    -0.01  -0.03  -0.19    -0.04  -0.10  -0.59
    28   1     0.27  -0.18   0.02    -0.01  -0.02  -0.07     0.01  -0.01   0.02
    29   1     0.06  -0.00  -0.01     0.00   0.00   0.00     0.00  -0.00   0.00
    30   1    -0.11  -0.21   0.05    -0.00  -0.00  -0.00    -0.00  -0.01   0.00
    31   1     0.06  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00   0.00
                     40                     41                     42
                      A                      A                      A
 Frequencies --    982.2348              1029.0133              1061.6700
 Red. masses --      3.5082                 2.1282                 4.7249
 Frc consts  --      1.9942                 1.3277                 3.1378
 IR Inten    --      0.9567                 3.4775                54.5933
 RamAct Fr= 1--     19.4554                 4.9930                 2.9039
  Dep-P Fr= 1--      0.1283                 0.3913                 0.3025
  Dep-U Fr= 1--      0.2274                 0.5625                 0.4644
 Alpha2 Fr= 1--      0.3177                 0.0381                 0.0296
 Beta2  Fr= 1--      0.7373                 0.4681                 0.2248
 AlphaG Fr= 1--     -0.1780                 0.1294                 0.0107
 Gamma2 Fr= 1--     -0.2308                -0.4159                 0.4970
 Delta2 Fr= 1--      0.3229                -1.2237                -0.0238
 Raman1 Fr= 1--      77.821                 19.972                 11.615
 ROA1   Fr= 1--     -11.822                -79.087                 46.948
 CID1   Fr= 1--      -0.152                 -3.960                  4.042
 Raman2 Fr= 1--       8.848                  5.617                  2.697
 ROA2   Fr= 1--      -8.123                 -0.192                 12.117
 CID2   Fr= 1--      -0.918                 -0.034                  4.492
 Raman3 Fr= 1--      17.695                 11.235                  5.395
 ROA3   Fr= 1--     -11.822                -79.087                 46.948
 CID3   Fr= 1--      -0.668                 -7.039                  8.703
 RC180  Fr= 1--      -0.545                  0.125                 -0.071
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01  -0.04   0.00     0.05  -0.00  -0.00    -0.01   0.01  -0.00
     2   6     0.03   0.02  -0.01     0.00  -0.02   0.00    -0.05  -0.03   0.01
     3   6     0.05   0.14  -0.02     0.04  -0.11   0.03     0.03   0.02  -0.00
     4   6    -0.07  -0.00  -0.00    -0.02  -0.02  -0.02     0.00  -0.01  -0.00
     5   6     0.00  -0.14   0.03    -0.03   0.09  -0.01     0.01  -0.02   0.00
     6   6     0.02   0.13  -0.02     0.02  -0.01   0.00     0.01   0.03  -0.01
     7   6    -0.02  -0.12   0.03     0.00   0.02  -0.00    -0.08  -0.04   0.01
     8   1     0.06   0.12  -0.09     0.23  -0.23  -0.04     0.10  -0.01  -0.02
     9   1    -0.11  -0.21   0.03     0.00   0.11  -0.05    -0.07  -0.06   0.01
    10   1    -0.23   0.26  -0.03     0.19  -0.10   0.00     0.06   0.01  -0.01
    11   6    -0.01   0.02   0.05    -0.11   0.09   0.13    -0.02   0.01   0.02
    12   6     0.05   0.00  -0.04     0.06  -0.04  -0.12    -0.00  -0.00  -0.02
    13   6     0.00  -0.01   0.01     0.03  -0.06   0.06     0.00  -0.01   0.01
    14   1    -0.05   0.03   0.15    -0.34   0.13   0.53    -0.01   0.03   0.06
    15   1    -0.08  -0.01   0.04    -0.10   0.04   0.22     0.01   0.01   0.01
    16   1     0.03   0.06  -0.23     0.06   0.21  -0.27     0.00   0.02   0.01
    17   1    -0.06   0.03  -0.00    -0.00   0.17  -0.33     0.02   0.02  -0.06
    18   8    -0.01  -0.00   0.00    -0.02   0.01   0.00    -0.00  -0.00   0.00
    19   8     0.01  -0.00  -0.02     0.01  -0.00  -0.05     0.00   0.00  -0.01
    20   1     0.01  -0.01  -0.02     0.02  -0.00  -0.06     0.01  -0.01  -0.02
    21   6    -0.05   0.25  -0.05    -0.03   0.01  -0.00     0.01  -0.11   0.02
    22   6     0.07  -0.03   0.00    -0.01  -0.00   0.00     0.19   0.07  -0.03
    23   6    -0.01  -0.24   0.04     0.00  -0.00   0.00    -0.02   0.05  -0.01
    24   8    -0.02   0.06  -0.01    -0.01  -0.01   0.00     0.15   0.27  -0.06
    25   6    -0.05  -0.04   0.01     0.01   0.01  -0.00    -0.17  -0.30   0.07
    26   1     0.33  -0.31  -0.00    -0.04   0.04  -0.01    -0.32   0.08   0.01
    27   1     0.08   0.34  -0.04    -0.06  -0.00   0.01    -0.26  -0.30   0.07
    28   1     0.12  -0.31   0.05     0.00  -0.00  -0.00    -0.39   0.25  -0.02
    29   1     0.04  -0.01  -0.00     0.01   0.01  -0.00    -0.15  -0.21   0.08
    30   1    -0.08  -0.15   0.03     0.01   0.01  -0.00    -0.12  -0.14   0.03
    31   1     0.04  -0.01   0.00     0.01   0.01  -0.00    -0.16  -0.22   0.02
                     43                     44                     45
                      A                      A                      A
 Frequencies --   1091.5827              1098.9056              1151.7242
 Red. masses --      2.1733                 1.9279                 1.4455
 Frc consts  --      1.5258                 1.3717                 1.1297
 IR Inten    --      3.2902                19.0391                14.8392
 RamAct Fr= 1--      2.4319                15.1531                 2.2731
  Dep-P Fr= 1--      0.6910                 0.1971                 0.6359
  Dep-U Fr= 1--      0.8173                 0.3293                 0.7774
 Alpha2 Fr= 1--      0.0025                 0.2074                 0.0047
 Beta2  Fr= 1--      0.3313                 0.8317                 0.2945
 AlphaG Fr= 1--      0.0042                -0.2590                 0.0012
 Gamma2 Fr= 1--     -0.1096                -2.0870                 0.1155
 Delta2 Fr= 1--      0.5074                 2.0212                -0.0697
 Raman1 Fr= 1--       9.728                 60.613                  9.092
 ROA1   Fr= 1--       5.719               -135.672                  8.859
 CID1   Fr= 1--       0.588                 -2.238                  0.974
 Raman2 Fr= 1--       3.975                  9.980                  3.534
 ROA2   Fr= 1--      -6.689                -66.257                  3.330
 CID2   Fr= 1--      -1.683                 -6.639                  0.942
 Raman3 Fr= 1--       7.950                 19.960                  7.069
 ROA3   Fr= 1--       5.719               -135.672                  8.859
 CID3   Fr= 1--       0.719                 -6.797                  1.253
 RC180  Fr= 1--       0.635                 -0.341                  0.555
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01  -0.02   0.00    -0.02  -0.01   0.00     0.01   0.08  -0.01
     2   6    -0.01   0.02  -0.00     0.00  -0.00  -0.00     0.02   0.04  -0.01
     3   6     0.01   0.00  -0.00    -0.02   0.06   0.00    -0.05  -0.04   0.01
     4   6     0.10   0.05  -0.00     0.05  -0.01  -0.06    -0.03  -0.02   0.00
     5   6     0.01  -0.06   0.01     0.01  -0.03   0.02     0.01   0.04  -0.01
     6   6    -0.05  -0.03   0.01    -0.01  -0.00   0.00    -0.02  -0.05   0.01
     7   6     0.01   0.01  -0.00     0.01   0.01  -0.00    -0.06  -0.05   0.01
     8   1    -0.16   0.10  -0.00    -0.21   0.15  -0.07     0.06  -0.10   0.01
     9   1    -0.05  -0.10   0.04    -0.03  -0.06  -0.03     0.26   0.19  -0.05
    10   1    -0.22   0.06   0.00    -0.10   0.04  -0.01    -0.06  -0.03   0.01
    11   6     0.05   0.15  -0.14     0.05  -0.01   0.16     0.04   0.01  -0.01
    12   6    -0.06  -0.14   0.06    -0.11   0.01  -0.12    -0.02  -0.01   0.00
    13   6     0.04  -0.09  -0.02    -0.01   0.01   0.09     0.00  -0.01   0.00
    14   1    -0.02   0.22   0.18     0.32   0.07   0.13     0.16   0.06   0.01
    15   1    -0.05   0.06   0.57     0.33   0.12  -0.23     0.04   0.02   0.03
    16   1    -0.04   0.23   0.25    -0.07  -0.06   0.52    -0.01   0.01   0.08
    17   1     0.09   0.20  -0.41     0.32  -0.01  -0.36     0.04   0.01  -0.06
    18   8    -0.02   0.00  -0.00    -0.04  -0.02   0.00    -0.01  -0.00  -0.00
    19   8    -0.02   0.02   0.03     0.04  -0.01  -0.06    -0.00   0.00   0.00
    20   1    -0.04   0.04   0.16     0.05  -0.04  -0.13    -0.00   0.01   0.02
    21   6    -0.01   0.00  -0.00     0.01  -0.01   0.00     0.05   0.02  -0.01
    22   6     0.00  -0.01   0.00    -0.00  -0.01   0.00    -0.04   0.00   0.00
    23   6     0.01   0.00  -0.00     0.01   0.01  -0.00    -0.03  -0.06   0.01
    24   8     0.00   0.00  -0.00    -0.01  -0.01   0.00     0.04   0.03  -0.01
    25   6    -0.00  -0.00   0.00     0.00   0.01  -0.00    -0.01  -0.04   0.01
    26   1     0.04  -0.01  -0.00     0.04  -0.00  -0.00    -0.39   0.12   0.01
    27   1    -0.07  -0.04   0.01    -0.02  -0.02   0.01     0.64   0.40  -0.12
    28   1     0.05  -0.02   0.00     0.02   0.01  -0.00     0.09  -0.12   0.02
    29   1     0.00  -0.00  -0.00     0.01   0.01  -0.00    -0.04  -0.02   0.02
    30   1    -0.01  -0.01   0.00    -0.00  -0.01   0.00     0.03   0.08  -0.02
    31   1     0.00   0.00   0.00     0.01   0.01   0.00    -0.04  -0.03  -0.00
                     46                     47                     48
                      A                      A                      A
 Frequencies --   1173.9724              1175.6043              1179.5644
 Red. masses --      1.2770                 1.8628                 1.6646
 Frc consts  --      1.0370                 1.5168                 1.3646
 IR Inten    --      0.8225                42.2800                10.3728
 RamAct Fr= 1--      0.8916                27.8122                19.5625
  Dep-P Fr= 1--      0.7500                 0.4328                 0.5537
  Dep-U Fr= 1--      0.8571                 0.6041                 0.7127
 Alpha2 Fr= 1--      0.0000                 0.1824                 0.0732
 Beta2  Fr= 1--      0.1274                 2.8004                 2.3238
 AlphaG Fr= 1--      0.0010                 0.0208                -0.0361
 Gamma2 Fr= 1--      0.0598                 4.1954                -2.2261
 Delta2 Fr= 1--      0.0246                 4.8984                -1.6367
 Raman1 Fr= 1--       3.567                111.249                 78.250
 ROA1   Fr= 1--       6.526                559.509               -266.080
 CID1   Fr= 1--       1.830                  5.029                 -3.400
 Raman2 Fr= 1--       1.528                 33.605                 27.885
 ROA2   Fr= 1--       1.239                 61.503                -40.333
 CID2   Fr= 1--       0.810                  1.830                 -1.446
 Raman3 Fr= 1--       3.057                 67.209                 55.771
 ROA3   Fr= 1--       6.526                559.509               -266.080
 CID3   Fr= 1--       2.135                  8.325                 -4.771
 RC180  Fr= 1--       0.714                  0.208                  0.425
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.00   0.00     0.03  -0.03   0.00     0.03  -0.03   0.00
     2   6     0.00   0.00   0.00    -0.00   0.06  -0.01     0.01   0.04  -0.01
     3   6     0.00  -0.00   0.00     0.01  -0.05   0.00     0.00  -0.04   0.01
     4   6     0.00   0.00   0.00     0.09   0.05   0.01    -0.01   0.01  -0.02
     5   6     0.00  -0.00  -0.00     0.06  -0.01  -0.01     0.06   0.01  -0.00
     6   6    -0.00  -0.00  -0.00    -0.07  -0.05   0.01    -0.06  -0.02   0.01
     7   6    -0.00  -0.00  -0.00     0.01   0.01  -0.00     0.01   0.00  -0.00
     8   1    -0.00   0.00   0.00    -0.17   0.04   0.03    -0.02  -0.04  -0.02
     9   1     0.00   0.00   0.00     0.40   0.19  -0.05     0.49   0.27  -0.10
    10   1    -0.00   0.00   0.00    -0.47   0.16   0.00    -0.43   0.17  -0.00
    11   6    -0.00  -0.00  -0.00    -0.05  -0.02  -0.04    -0.00  -0.02   0.08
    12   6     0.00  -0.00   0.00     0.02  -0.01   0.01    -0.01   0.04  -0.03
    13   6    -0.00   0.00   0.00    -0.04   0.09   0.14     0.03  -0.06  -0.14
    14   1    -0.00  -0.00  -0.00    -0.34  -0.17  -0.18     0.02   0.02   0.17
    15   1    -0.00  -0.00   0.00    -0.08  -0.03   0.04     0.07   0.02  -0.17
    16   1     0.00   0.00  -0.00     0.01   0.01  -0.11    -0.00  -0.06   0.05
    17   1    -0.00   0.00   0.00    -0.07   0.01   0.04     0.04  -0.05   0.05
    18   8    -0.00  -0.00  -0.00    -0.03  -0.03   0.00     0.04   0.03   0.00
    19   8     0.00   0.00  -0.00     0.05   0.00  -0.05    -0.05  -0.01   0.04
    20   1     0.00  -0.00  -0.00     0.10  -0.12  -0.43    -0.11   0.12   0.43
    21   6    -0.00  -0.00  -0.00    -0.02   0.02  -0.00    -0.02   0.02  -0.00
    22   6    -0.00  -0.00  -0.00    -0.02  -0.02   0.00    -0.00  -0.02   0.00
    23   6    -0.00  -0.00  -0.00    -0.03  -0.00   0.00    -0.03   0.01   0.00
    24   8     0.00   0.01   0.06     0.03   0.02  -0.01     0.01   0.01  -0.00
    25   6    -0.01  -0.02  -0.14    -0.00  -0.03   0.01    -0.00  -0.01   0.00
    26   1     0.00   0.00   0.00     0.06  -0.02   0.00     0.18  -0.08   0.00
    27   1    -0.00   0.00   0.01    -0.13  -0.05   0.02    -0.24  -0.12   0.04
    28   1     0.00   0.00   0.02     0.10  -0.07   0.01    -0.00  -0.00   0.00
    29   1     0.30   0.59   0.05    -0.02  -0.02   0.01    -0.01  -0.01   0.00
    30   1     0.02   0.05   0.28     0.02   0.05  -0.01     0.00   0.01  -0.00
    31   1    -0.28  -0.53   0.30    -0.02  -0.01  -0.01    -0.01  -0.01  -0.00
                     49                     50                     51
                      A                      A                      A
 Frequencies --   1194.6436              1199.0277              1222.1315
 Red. masses --      1.4623                 1.5793                 1.7380
 Frc consts  --      1.2296                 1.3378                 1.5294
 IR Inten    --     14.7381                26.0099                17.4943
 RamAct Fr= 1--      3.5067                57.5661                10.6139
  Dep-P Fr= 1--      0.5747                 0.1223                 0.2801
  Dep-U Fr= 1--      0.7299                 0.2179                 0.4376
 Alpha2 Fr= 1--      0.0116                 0.9540                 0.1155
 Beta2  Fr= 1--      0.4266                 2.0908                 0.7741
 AlphaG Fr= 1--      0.0064                -0.0905                -0.0340
 Gamma2 Fr= 1--     -2.1658                -1.2373                 1.2149
 Delta2 Fr= 1--     -0.9308                -0.0484                -0.6027
 Raman1 Fr= 1--      14.027                230.264                 42.456
 ROA1   Fr= 1--    -237.700               -120.330                 97.344
 CID1   Fr= 1--     -16.946                 -0.523                  2.293
 Raman2 Fr= 1--       5.119                 25.090                  9.289
 ROA2   Fr= 1--     -44.533                -29.309                 33.979
 CID2   Fr= 1--      -8.699                 -1.168                  3.658
 Raman3 Fr= 1--      10.239                 50.180                 18.578
 ROA3   Fr= 1--    -237.700               -120.330                 97.344
 CID3   Fr= 1--     -23.216                 -2.398                  5.240
 RC180  Fr= 1--       0.460                 -0.564                 -0.125
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.07   0.05  -0.00    -0.01  -0.02   0.00     0.06  -0.05   0.00
     2   6    -0.06   0.07  -0.01    -0.04   0.03  -0.00     0.11  -0.08   0.01
     3   6     0.02  -0.00  -0.00     0.02  -0.01   0.00    -0.03   0.01  -0.00
     4   6    -0.06   0.01   0.00     0.12   0.05  -0.02    -0.04  -0.05   0.01
     5   6    -0.01   0.00   0.00    -0.01  -0.05   0.01    -0.01   0.04  -0.01
     6   6     0.03  -0.04   0.00     0.00  -0.04   0.01     0.00   0.05  -0.01
     7   6     0.04  -0.04   0.00     0.00   0.03  -0.00    -0.00   0.03  -0.01
     8   1     0.32  -0.16   0.02    -0.29   0.15  -0.02    -0.14   0.07  -0.00
     9   1     0.14   0.10  -0.03    -0.32  -0.25   0.06    -0.05   0.02   0.00
    10   1     0.26  -0.16   0.01     0.14  -0.12   0.01    -0.18   0.16  -0.02
    11   6     0.05   0.00  -0.02    -0.05  -0.02   0.05    -0.00   0.01  -0.02
    12   6    -0.02  -0.02   0.01     0.01   0.04  -0.02     0.01  -0.01   0.01
    13   6    -0.00   0.00   0.02     0.00  -0.00  -0.06     0.01  -0.01   0.01
    14   1     0.19   0.04  -0.05    -0.39  -0.13   0.09     0.17   0.07  -0.01
    15   1     0.03   0.01   0.04     0.00  -0.00  -0.13    -0.02  -0.01   0.05
    16   1    -0.01   0.01   0.05     0.00  -0.05  -0.01     0.01   0.02  -0.03
    17   1     0.04   0.01  -0.05    -0.01  -0.04   0.08    -0.02   0.02  -0.01
    18   8    -0.01  -0.01  -0.00     0.02   0.01   0.00    -0.00   0.00  -0.00
    19   8     0.01   0.00  -0.01    -0.02  -0.01   0.02     0.00   0.00  -0.00
    20   1     0.02  -0.02  -0.06    -0.04   0.04   0.16     0.00  -0.00  -0.04
    21   6    -0.03  -0.01   0.00    -0.00   0.01  -0.00    -0.00   0.01  -0.00
    22   6    -0.05   0.02  -0.00    -0.07   0.01   0.00    -0.01  -0.01   0.00
    23   6     0.01  -0.00  -0.00     0.02  -0.01   0.00    -0.01  -0.02   0.00
    24   8     0.01   0.04  -0.01     0.02   0.04  -0.01    -0.08   0.04  -0.00
    25   6     0.04  -0.05   0.01     0.03  -0.05   0.01     0.13  -0.05   0.00
    26   1     0.45  -0.26   0.01    -0.13   0.10  -0.01    -0.06   0.07  -0.01
    27   1    -0.18  -0.10   0.03     0.15   0.10  -0.03    -0.09  -0.04   0.01
    28   1     0.36  -0.18   0.01     0.38  -0.20   0.01    -0.24   0.09   0.00
    29   1    -0.16  -0.05   0.06    -0.15  -0.04   0.06    -0.37  -0.09   0.13
    30   1     0.14   0.30  -0.06     0.13   0.29  -0.06     0.30   0.55  -0.12
    31   1    -0.17  -0.07  -0.02    -0.15  -0.06  -0.02    -0.38  -0.12  -0.03
                     52                     53                     54
                      A                      A                      A
 Frequencies --   1246.8011              1294.8685              1298.1125
 Red. masses --      2.0031                 2.0937                 1.4499
 Frc consts  --      1.8346                 2.0683                 1.4395
 IR Inten    --    139.8618               121.8660               137.6017
 RamAct Fr= 1--      7.4478                18.4424                12.0170
  Dep-P Fr= 1--      0.2870                 0.3120                 0.7427
  Dep-U Fr= 1--      0.4460                 0.4756                 0.8524
 Alpha2 Fr= 1--      0.0794                 0.1824                 0.0015
 Beta2  Fr= 1--      0.5536                 1.4618                 1.7071
 AlphaG Fr= 1--      0.0459                 0.0438                -0.0091
 Gamma2 Fr= 1--      1.6986                 5.4784                -3.9155
 Delta2 Fr= 1--      0.9222                 0.0069                -2.8481
 Raman1 Fr= 1--      29.791                 73.770                 48.068
 ROA1   Fr= 1--     192.578                526.146               -467.024
 CID1   Fr= 1--       6.464                  7.132                 -9.716
 Raman2 Fr= 1--       6.643                 17.541                 20.485
 ROA2   Fr= 1--      33.390                131.426                -71.186
 CID2   Fr= 1--       5.026                  7.492                 -3.475
 Raman3 Fr= 1--      13.286                 35.083                 40.971
 ROA3   Fr= 1--     192.578                526.146               -467.024
 CID3   Fr= 1--      14.495                 14.997                -11.399
 RC180  Fr= 1--      -0.108                 -0.049                  0.705
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.11  -0.10   0.01     0.05   0.04  -0.01     0.02  -0.03   0.01
     2   6    -0.01  -0.00   0.00     0.15   0.01  -0.01    -0.05   0.00   0.00
     3   6    -0.02   0.04  -0.01    -0.06  -0.01   0.01     0.01   0.00  -0.00
     4   6    -0.07  -0.09   0.02    -0.01  -0.00  -0.00    -0.04  -0.01   0.00
     5   6     0.01   0.01  -0.00    -0.01   0.03  -0.00     0.00  -0.02   0.00
     6   6    -0.00   0.03  -0.01     0.01  -0.02   0.00    -0.00   0.02  -0.00
     7   6     0.01   0.06  -0.01    -0.01   0.02  -0.00     0.01  -0.01   0.00
     8   1    -0.43   0.25  -0.02     0.00  -0.04   0.01    -0.05   0.04   0.00
     9   1     0.10   0.07  -0.02    -0.30  -0.15   0.04     0.13   0.06  -0.03
    10   1     0.28  -0.12   0.00     0.04  -0.04   0.00     0.07  -0.02   0.00
    11   6    -0.05   0.00  -0.02     0.06   0.03   0.03     0.01   0.03   0.05
    12   6     0.03  -0.01   0.01    -0.01  -0.03  -0.01     0.01  -0.05  -0.00
    13   6     0.02  -0.03   0.00    -0.02   0.04   0.03    -0.02   0.05   0.07
    14   1     0.45   0.20   0.02    -0.27  -0.19  -0.28     0.02  -0.15  -0.56
    15   1    -0.06  -0.02   0.06     0.04   0.02   0.06    -0.02  -0.01   0.14
    16   1     0.02   0.02  -0.08    -0.01   0.06   0.03     0.02   0.11  -0.05
    17   1    -0.05   0.03   0.01     0.03   0.01  -0.08    -0.01   0.06  -0.12
    18   8    -0.01   0.01   0.00     0.02   0.00  -0.01     0.04   0.01  -0.02
    19   8     0.00   0.01   0.01    -0.01  -0.02  -0.04    -0.01  -0.04  -0.07
    20   1     0.02  -0.03  -0.13    -0.07   0.11   0.34    -0.12   0.19   0.59
    21   6    -0.01   0.04  -0.01    -0.02   0.01   0.00     0.01   0.01  -0.00
    22   6    -0.11  -0.04   0.02    -0.14  -0.09   0.03     0.05   0.03  -0.01
    23   6    -0.05   0.06  -0.01    -0.08   0.02   0.00     0.02  -0.01  -0.00
    24   8     0.10   0.02  -0.01     0.10   0.03  -0.01    -0.03  -0.01   0.00
    25   6    -0.05  -0.03   0.01    -0.04  -0.04   0.01     0.01   0.01  -0.00
    26   1    -0.07   0.11  -0.02     0.46  -0.23   0.01    -0.25   0.13  -0.00
    27   1    -0.16  -0.05   0.02     0.07   0.07  -0.02    -0.10  -0.06   0.02
    28   1     0.39  -0.17   0.00    -0.34   0.15  -0.00     0.18  -0.09   0.00
    29   1     0.14   0.03  -0.03     0.10   0.03  -0.01    -0.03  -0.02   0.00
    30   1    -0.05  -0.05   0.01    -0.01   0.01  -0.00     0.00  -0.00   0.00
    31   1     0.14   0.04  -0.00     0.10   0.03  -0.02    -0.03  -0.01   0.01
                     55                     56                     57
                      A                      A                      A
 Frequencies --   1302.9977              1323.5338              1335.9201
 Red. masses --      1.9947                 2.1191                 1.7739
 Frc consts  --      1.9953                 2.1872                 1.8653
 IR Inten    --     37.1455                18.8266               142.0692
 RamAct Fr= 1--      1.7678                39.2170                 5.9462
  Dep-P Fr= 1--      0.2944                 0.2041                 0.7053
  Dep-U Fr= 1--      0.4549                 0.3390                 0.8272
 Alpha2 Fr= 1--      0.0184                 0.5268                 0.0046
 Beta2  Fr= 1--      0.1340                 2.2157                 0.8198
 AlphaG Fr= 1--      0.0142                 0.3482                -0.0598
 Gamma2 Fr= 1--     -0.9933                -0.5310                 4.3206
 Delta2 Fr= 1--      0.0643                 0.3983                 2.0055
 Raman1 Fr= 1--       7.071                156.868                 23.785
 ROA1   Fr= 1--     -93.298                -38.235                478.957
 CID1   Fr= 1--     -13.194                 -0.244                 20.137
 Raman2 Fr= 1--       1.608                 26.588                  9.837
 ROA2   Fr= 1--     -24.354                -15.931                 87.651
 CID2   Fr= 1--     -15.143                 -0.599                  8.910
 Raman3 Fr= 1--       3.217                 53.176                 19.675
 ROA3   Fr= 1--     -93.298                -38.235                478.957
 CID3   Fr= 1--     -29.006                 -0.719                 24.344
 RC180  Fr= 1--      -0.090                 -0.322                  0.654
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.09  -0.11   0.03     0.11  -0.06   0.00     0.01  -0.00  -0.00
     2   6    -0.02  -0.16   0.03     0.01   0.01  -0.00    -0.00  -0.00   0.00
     3   6     0.04   0.05  -0.01    -0.04  -0.03   0.01    -0.01   0.01  -0.00
     4   6    -0.02   0.02  -0.00    -0.14   0.04   0.00    -0.01  -0.01   0.02
     5   6     0.03   0.01  -0.01    -0.01  -0.02   0.01     0.00  -0.00  -0.00
     6   6     0.00   0.06  -0.01     0.02   0.02  -0.01     0.00   0.01  -0.00
     7   6    -0.01   0.09  -0.02     0.03  -0.01   0.00     0.00  -0.00   0.00
     8   1     0.61  -0.24   0.01     0.07  -0.10   0.02    -0.01   0.01   0.02
     9   1    -0.09  -0.05   0.02    -0.00  -0.01   0.00     0.02   0.01   0.02
    10   1    -0.43   0.29  -0.02     0.12  -0.03  -0.00     0.04  -0.02   0.00
    11   6     0.02   0.00  -0.00     0.20   0.03  -0.01     0.02  -0.07  -0.15
    12   6    -0.01  -0.00   0.00    -0.06   0.01   0.00    -0.03   0.06   0.03
    13   6    -0.00   0.01   0.01    -0.02   0.01  -0.05     0.00   0.03   0.16
    14   1    -0.05  -0.03  -0.02    -0.59  -0.22   0.12    -0.08   0.16   0.72
    15   1     0.02   0.00  -0.01     0.19   0.07  -0.07     0.02  -0.01  -0.20
    16   1    -0.01   0.02   0.00    -0.05  -0.00   0.12    -0.03  -0.16  -0.01
    17   1     0.01   0.01  -0.02     0.15  -0.08  -0.02     0.06  -0.06   0.11
    18   8     0.00  -0.00  -0.00    -0.02  -0.02   0.01     0.02   0.01  -0.03
    19   8    -0.00  -0.00  -0.00     0.01   0.01   0.03    -0.01  -0.03  -0.08
    20   1    -0.01   0.01   0.04     0.05  -0.07  -0.22    -0.09   0.15   0.51
    21   6     0.02  -0.02   0.00     0.00   0.04  -0.01     0.00   0.00  -0.00
    22   6    -0.10  -0.03   0.01     0.01   0.03  -0.01     0.00   0.00  -0.00
    23   6     0.04   0.06  -0.01    -0.04  -0.01   0.00    -0.01   0.00  -0.00
    24   8     0.05   0.01  -0.01    -0.00  -0.01   0.00     0.00  -0.00  -0.00
    25   6    -0.02  -0.02   0.01    -0.00   0.00  -0.00    -0.00   0.00   0.00
    26   1    -0.07   0.13  -0.02    -0.36   0.20  -0.01    -0.02   0.01   0.00
    27   1     0.17   0.08  -0.03    -0.29  -0.14   0.05    -0.03  -0.01   0.01
    28   1     0.32  -0.09  -0.01     0.15  -0.11   0.01     0.04  -0.02   0.00
    29   1     0.07   0.03  -0.01     0.01  -0.00  -0.01     0.00  -0.00  -0.00
    30   1     0.01   0.07  -0.01    -0.00   0.00   0.00    -0.00   0.00   0.00
    31   1     0.07   0.03  -0.01     0.01  -0.00   0.01     0.00  -0.00   0.00
                     58                     59                     60
                      A                      A                      A
 Frequencies --   1385.9836              1400.3482              1415.3191
 Red. masses --      1.8695                 5.0267                 1.2170
 Frc consts  --      2.1159                 5.8077                 1.4363
 IR Inten    --      7.4996                 0.5549                10.8150
 RamAct Fr= 1--      2.5798               458.6959                 1.1072
  Dep-P Fr= 1--      0.1569                 0.2163                 0.1556
  Dep-U Fr= 1--      0.2712                 0.3557                 0.2693
 Alpha2 Fr= 1--      0.0392                 5.9632                 0.0169
 Beta2  Fr= 1--      0.1166                27.1931                 0.0497
 AlphaG Fr= 1--     -0.0265                -0.1114                -0.0191
 Gamma2 Fr= 1--     -0.1513                 0.3957                -0.2521
 Delta2 Fr= 1--     -0.3214                 2.7727                -0.0250
 Raman1 Fr= 1--      10.319               1834.784                  4.429
 ROA1   Fr= 1--     -24.812                126.712                -25.000
 CID1   Fr= 1--      -2.404                  0.069                 -5.645
 Raman2 Fr= 1--       1.399                326.317                  0.596
 ROA2   Fr= 1--      -1.061                -12.686                 -5.849
 CID2   Fr= 1--      -0.758                 -0.039                 -9.807
 Raman3 Fr= 1--       2.799                652.635                  1.193
 ROA3   Fr= 1--     -24.812                126.712                -25.000
 CID3   Fr= 1--      -8.865                  0.194                -20.957
 RC180  Fr= 1--      -0.458                 -0.289                 -0.461
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03   0.05  -0.01     0.14   0.25  -0.06    -0.01  -0.01   0.00
     2   6     0.08   0.01  -0.01    -0.09  -0.22   0.05     0.01   0.00  -0.00
     3   6    -0.06  -0.04   0.01    -0.19   0.11  -0.01     0.01   0.00   0.00
     4   6     0.01   0.09  -0.02     0.09  -0.20   0.03    -0.01   0.00   0.00
     5   6     0.00   0.04  -0.01     0.22   0.09  -0.03    -0.02  -0.01   0.00
     6   6     0.07  -0.07   0.01    -0.20   0.05   0.01     0.01   0.00  -0.00
     7   6     0.05  -0.07   0.01    -0.01  -0.09   0.02     0.00   0.00  -0.00
     8   1     0.13  -0.15   0.02     0.10  -0.03  -0.00     0.02  -0.01  -0.01
     9   1    -0.42  -0.21   0.07    -0.15  -0.16   0.04     0.03   0.03  -0.01
    10   1    -0.36   0.15  -0.00    -0.02  -0.06   0.01     0.01   0.00  -0.00
    11   6    -0.06  -0.03   0.01     0.00   0.02   0.00     0.01  -0.00  -0.01
    12   6     0.02  -0.00   0.00     0.01  -0.00  -0.02     0.04   0.02  -0.13
    13   6     0.01  -0.01   0.01    -0.00   0.00  -0.01    -0.01   0.00   0.01
    14   1     0.40   0.12  -0.04    -0.34  -0.10   0.03    -0.02  -0.00   0.04
    15   1    -0.06  -0.03   0.01    -0.01   0.02   0.06    -0.23   0.12   0.45
    16   1     0.01  -0.02  -0.02     0.01   0.04   0.10     0.07  -0.05   0.59
    17   1    -0.04   0.02  -0.00    -0.07  -0.03   0.07    -0.33  -0.24   0.43
    18   8     0.00   0.00  -0.00     0.00   0.00   0.00     0.01   0.00  -0.00
    19   8    -0.00  -0.00  -0.01     0.00   0.00   0.01     0.00  -0.00  -0.01
    20   1    -0.01   0.01   0.02    -0.00   0.00  -0.02    -0.00   0.01   0.02
    21   6     0.02   0.01  -0.00     0.01  -0.01   0.00     0.00   0.00  -0.00
    22   6    -0.03   0.13  -0.02     0.04   0.07  -0.01    -0.00   0.00   0.00
    23   6    -0.09  -0.05   0.02     0.02   0.03  -0.01    -0.00  -0.00   0.00
    24   8     0.02  -0.03   0.00    -0.02  -0.01   0.00     0.00  -0.00  -0.00
    25   6    -0.02   0.00   0.00    -0.00   0.01  -0.00    -0.00  -0.00   0.00
    26   1    -0.25   0.08   0.00     0.23  -0.23   0.02    -0.02   0.01  -0.00
    27   1    -0.34  -0.22   0.06    -0.16  -0.12   0.03    -0.01  -0.01   0.00
    28   1     0.17  -0.19   0.02     0.47  -0.21   0.01    -0.01   0.00   0.00
    29   1     0.08   0.01  -0.03     0.01  -0.01  -0.01     0.01   0.00  -0.00
    30   1    -0.02   0.01  -0.00     0.00   0.02  -0.00     0.00   0.01  -0.00
    31   1     0.08   0.01   0.01     0.01  -0.01   0.02     0.01   0.00  -0.00
                     61                     62                     63
                      A                      A                      A
 Frequencies --   1426.8675              1456.9537              1476.1770
 Red. masses --      3.5392                 3.5786                 1.2342
 Frc consts  --      4.2454                 4.4757                 1.5846
 IR Inten    --     78.2201                12.0604                 7.4485
 RamAct Fr= 1--    229.2415               153.3169                12.1059
  Dep-P Fr= 1--      0.2187                 0.2315                 0.5769
  Dep-U Fr= 1--      0.3589                 0.3760                 0.7317
 Alpha2 Fr= 1--      2.9614                 1.9126                 0.0394
 Beta2  Fr= 1--     13.7112                 9.6070                 1.4763
 AlphaG Fr= 1--     -0.2286                -0.5647                -0.0166
 Gamma2 Fr= 1--     -1.1866                -2.6758                 0.8203
 Delta2 Fr= 1--      1.1792                -0.0120                 0.4182
 Raman1 Fr= 1--     916.966                613.268                 48.424
 ROA1   Fr= 1--     -76.185               -257.256                 92.129
 CID1   Fr= 1--      -0.083                 -0.419                  1.903
 Raman2 Fr= 1--     164.534                115.284                 17.715
 ROA2   Fr= 1--     -37.913                -64.123                 16.342
 CID2   Fr= 1--      -0.230                 -0.556                  0.922
 Raman3 Fr= 1--     329.068                230.568                 35.430
 ROA3   Fr= 1--     -76.185               -257.256                 92.129
 CID3   Fr= 1--      -0.232                 -1.116                  2.600
 RC180  Fr= 1--      -0.282                 -0.248                  0.463
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.02  -0.14   0.03     0.18  -0.01  -0.01    -0.02  -0.00   0.00
     2   6     0.08   0.15  -0.03    -0.17   0.02   0.01     0.01   0.02  -0.00
     3   6    -0.08   0.07  -0.01    -0.11  -0.05   0.02    -0.01   0.02  -0.00
     4   6     0.06   0.02  -0.01    -0.04   0.20  -0.03     0.03   0.00  -0.00
     5   6     0.10   0.01  -0.01     0.12  -0.05   0.00     0.00  -0.02   0.00
     6   6    -0.11  -0.05   0.02    -0.08  -0.00   0.01    -0.04   0.01   0.00
     7   6    -0.15   0.01   0.01     0.13  -0.00  -0.01     0.00  -0.03   0.00
     8   1     0.53  -0.25   0.01     0.26  -0.26   0.03     0.10  -0.04   0.00
     9   1    -0.18  -0.18   0.04    -0.19  -0.25   0.06     0.08   0.03  -0.01
    10   1     0.27  -0.26   0.03     0.07  -0.10   0.01     0.13  -0.07   0.00
    11   6    -0.03  -0.01   0.01    -0.02  -0.05   0.01    -0.01  -0.00   0.00
    12   6     0.01  -0.00  -0.00     0.01   0.00  -0.01     0.00  -0.00   0.00
    13   6     0.00  -0.00  -0.00     0.00   0.00   0.02     0.00  -0.00  -0.00
    14   1     0.09   0.03  -0.01     0.38   0.10  -0.03    -0.00  -0.00   0.00
    15   1    -0.04  -0.02  -0.02    -0.07  -0.01   0.03    -0.03  -0.03  -0.04
    16   1     0.01   0.02   0.01     0.01  -0.06   0.04     0.00  -0.00   0.02
    17   1    -0.06   0.03  -0.00    -0.02  -0.00   0.02    -0.03   0.04  -0.03
    18   8     0.00   0.00   0.00    -0.00   0.00  -0.00     0.00   0.00   0.00
    19   8     0.00   0.00   0.00     0.00  -0.00  -0.01    -0.00   0.00   0.00
    20   1    -0.00   0.00  -0.02    -0.01   0.02   0.01    -0.00  -0.00   0.00
    21   6     0.17   0.08  -0.03    -0.15   0.04   0.00     0.04   0.03  -0.01
    22   6     0.12  -0.17   0.02    -0.02  -0.14   0.03     0.01  -0.02   0.00
    23   6    -0.14   0.11  -0.01     0.14   0.00  -0.01     0.03  -0.01   0.00
    24   8    -0.06   0.01   0.00     0.01   0.04  -0.01    -0.03  -0.02   0.01
    25   6     0.05   0.03  -0.01     0.03  -0.01   0.00    -0.05  -0.08   0.02
    26   1    -0.07  -0.05   0.01    -0.11   0.15  -0.02    -0.13   0.04   0.00
    27   1    -0.12  -0.11   0.03     0.10   0.23  -0.05    -0.12  -0.07   0.02
    28   1     0.20  -0.05  -0.00    -0.35   0.27  -0.02    -0.14   0.08  -0.00
    29   1    -0.19  -0.12   0.00    -0.11   0.07   0.07     0.38   0.36   0.07
    30   1    -0.01  -0.15   0.03    -0.00  -0.10   0.02     0.13   0.54  -0.11
    31   1    -0.19  -0.11   0.07    -0.12   0.04  -0.08     0.35   0.30  -0.24
                     64                     65                     66
                      A                      A                      A
 Frequencies --   1492.4741              1493.1481              1497.1000
 Red. masses --      1.0479                 1.0461                 1.0559
 Frc consts  --      1.3753                 1.3741                 1.3944
 IR Inten    --      8.7035                 8.7877                 7.1797
 RamAct Fr= 1--      6.0067                 9.7220                 4.3462
  Dep-P Fr= 1--      0.7417                 0.7500                 0.7152
  Dep-U Fr= 1--      0.8517                 0.8571                 0.8339
 Alpha2 Fr= 1--      0.0008                 0.0000                 0.0026
 Beta2  Fr= 1--      0.8527                 1.3888                 0.6041
 AlphaG Fr= 1--     -0.0024                -0.0014                 0.0483
 Gamma2 Fr= 1--      0.6499                -0.1227                 1.1617
 Delta2 Fr= 1--     -0.5810                 0.0525                 1.9737
 Raman1 Fr= 1--      24.027                 38.888                 17.385
 ROA1   Fr= 1--      43.802                -10.097                174.684
 CID1   Fr= 1--       1.823                 -0.260                 10.048
 Raman2 Fr= 1--      10.232                 16.666                  7.249
 ROA2   Fr= 1--      20.246                 -3.364                 12.092
 CID2   Fr= 1--       1.979                 -0.202                  1.668
 Raman3 Fr= 1--      20.464                 33.332                 14.498
 ROA3   Fr= 1--      43.802                -10.097                174.684
 CID3   Fr= 1--       2.140                 -0.303                 12.049
 RC180  Fr= 1--       0.703                  0.714                  0.668
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00   0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
     2   6    -0.00   0.00  -0.00     0.00   0.00   0.00    -0.01   0.01  -0.00
     3   6     0.00  -0.00  -0.00     0.00  -0.00  -0.00     0.00  -0.00  -0.00
     4   6     0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00   0.00
     5   6     0.01   0.00  -0.00    -0.00   0.00  -0.00     0.01   0.01  -0.00
     6   6    -0.00  -0.00   0.00     0.00  -0.00   0.00     0.00  -0.01   0.00
     7   6    -0.01   0.00   0.00     0.00   0.00   0.00    -0.00   0.00  -0.00
     8   1     0.00  -0.00  -0.00    -0.00   0.00   0.00    -0.01   0.01   0.01
     9   1    -0.02  -0.02   0.00    -0.00   0.00  -0.00    -0.04  -0.02   0.01
    10   1    -0.01  -0.00   0.00    -0.00   0.00  -0.00    -0.03   0.01   0.00
    11   6    -0.02   0.01   0.00     0.00  -0.00  -0.00    -0.02  -0.02  -0.01
    12   6    -0.03   0.03  -0.02     0.00  -0.00   0.00    -0.03  -0.04  -0.01
    13   6     0.00   0.00   0.00    -0.00  -0.00  -0.00    -0.00  -0.00   0.01
    14   1     0.03   0.02  -0.06    -0.00  -0.00   0.00     0.04   0.02   0.04
    15   1     0.03   0.21   0.46     0.00  -0.00  -0.00     0.62   0.23   0.06
    16   1    -0.05  -0.37  -0.34     0.00   0.00   0.00    -0.02   0.60  -0.17
    17   1     0.57  -0.39   0.11    -0.00   0.00  -0.00    -0.12  -0.23   0.30
    18   8    -0.00  -0.00   0.00     0.00   0.00   0.00     0.01   0.00  -0.00
    19   8     0.00  -0.00  -0.00     0.00   0.00   0.00    -0.00  -0.00  -0.00
    20   1    -0.00   0.00  -0.00     0.00  -0.00  -0.00    -0.00   0.00   0.00
    21   6     0.01   0.00  -0.00    -0.00   0.00   0.00    -0.00  -0.00   0.00
    22   6     0.01  -0.01   0.00    -0.00  -0.00  -0.00     0.01  -0.00   0.00
    23   6    -0.00   0.00  -0.00     0.00   0.00   0.00     0.00   0.00  -0.00
    24   8    -0.01  -0.00   0.00    -0.00  -0.00  -0.01    -0.00  -0.00   0.00
    25   6    -0.00  -0.01   0.00    -0.00  -0.01  -0.06    -0.00  -0.01   0.00
    26   1     0.01  -0.01   0.00     0.00  -0.00  -0.00     0.00  -0.00   0.00
    27   1     0.00  -0.00  -0.00     0.00  -0.00  -0.00     0.01   0.01  -0.00
    28   1     0.01  -0.00  -0.00    -0.00  -0.00  -0.03    -0.00   0.01  -0.00
    29   1     0.02   0.03   0.01    -0.48  -0.00   0.11     0.01   0.04   0.02
    30   1     0.01   0.04  -0.00     0.05   0.13   0.71     0.00   0.02  -0.00
    31   1     0.03   0.02  -0.02     0.48   0.03   0.03     0.01   0.03  -0.03
                     67                     68                     69
                      A                      A                      A
 Frequencies --   1506.0519              1524.8817              1547.2556
 Red. masses --      1.0655                 2.3850                 3.6146
 Frc consts  --      1.4240                 3.2675                 5.0984
 IR Inten    --     38.8858                59.9367                26.0772
 RamAct Fr= 1--      1.9610               146.3189                 6.4439
  Dep-P Fr= 1--      0.7356                 0.2398                 0.2808
  Dep-U Fr= 1--      0.8477                 0.3868                 0.4385
 Alpha2 Fr= 1--      0.0005                 1.7843                 0.0699
 Beta2  Fr= 1--      0.2771                 9.4320                 0.4709
 AlphaG Fr= 1--      0.0006                -0.2089                -0.1075
 Gamma2 Fr= 1--     -0.0366                -0.5150                -1.3074
 Delta2 Fr= 1--     -0.0788                 0.5035                 0.3683
 Raman1 Fr= 1--       7.844                585.275                 25.776
 ROA1   Fr= 1--      -6.034                -33.328               -113.728
 CID1   Fr= 1--      -0.769                 -0.057                 -4.412
 Raman2 Fr= 1--       3.325                113.184                  5.651
 ROA2   Fr= 1--      -0.248                -16.388                -34.324
 CID2   Fr= 1--      -0.075                 -0.145                 -6.074
 Raman3 Fr= 1--       6.649                226.369                 11.303
 ROA3   Fr= 1--      -6.034                -33.328               -113.728
 CID3   Fr= 1--      -0.907                 -0.147                -10.062
 RC180  Fr= 1--       0.695                 -0.226                 -0.123
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.02   0.01  -0.00     0.10  -0.04   0.00     0.10  -0.05   0.00
     2   6     0.00  -0.00   0.00    -0.08   0.04  -0.00     0.14  -0.09   0.01
     3   6     0.01   0.01  -0.00     0.05  -0.05   0.01    -0.08  -0.03   0.01
     4   6     0.00  -0.02   0.00    -0.12   0.02   0.01     0.08   0.17  -0.04
     5   6    -0.01   0.01  -0.00     0.07   0.07  -0.02    -0.08  -0.15   0.03
     6   6     0.01  -0.01   0.00     0.07  -0.07   0.01    -0.12   0.14  -0.02
     7   6     0.00  -0.01   0.00    -0.11   0.09  -0.01    -0.08   0.10  -0.01
     8   1    -0.02   0.02  -0.00    -0.20   0.07   0.00     0.20  -0.19   0.02
     9   1    -0.01   0.01  -0.00    -0.32  -0.16   0.05     0.37   0.11  -0.05
    10   1    -0.04   0.02  -0.00    -0.29   0.11   0.00     0.44  -0.14  -0.00
    11   6     0.00   0.00  -0.00     0.03  -0.00  -0.00    -0.03  -0.03   0.01
    12   6     0.00   0.00   0.00     0.01   0.00  -0.00    -0.00  -0.00   0.00
    13   6    -0.00  -0.00  -0.00    -0.00   0.00   0.00     0.00   0.00   0.00
    14   1    -0.03  -0.01   0.00     0.03   0.00  -0.00     0.16   0.04  -0.02
    15   1    -0.02  -0.01  -0.00    -0.08  -0.04  -0.03     0.04   0.02   0.01
    16   1     0.00  -0.02   0.01     0.01  -0.04   0.08    -0.00   0.03  -0.04
    17   1     0.00   0.01  -0.01    -0.05   0.05  -0.03     0.01  -0.03   0.02
    18   8     0.00   0.00  -0.00    -0.00  -0.00  -0.00    -0.00  -0.00   0.00
    19   8    -0.00   0.00   0.00     0.00  -0.00  -0.00    -0.00  -0.00  -0.00
    20   1     0.00  -0.00   0.00     0.00   0.00  -0.01    -0.00   0.01   0.00
    21   6     0.01   0.01  -0.00    -0.05  -0.09   0.02    -0.06  -0.13   0.03
    22   6    -0.01   0.00   0.00     0.16   0.01  -0.01     0.05   0.18  -0.04
    23   6    -0.01   0.00  -0.00    -0.06   0.04  -0.00    -0.08  -0.05   0.01
    24   8     0.02  -0.01   0.00    -0.06  -0.02   0.01     0.00  -0.03   0.00
    25   6     0.04  -0.03   0.00    -0.03  -0.03   0.01    -0.01  -0.01   0.00
    26   1    -0.02   0.00   0.00     0.38  -0.17   0.00     0.33  -0.11  -0.00
    27   1    -0.04  -0.03   0.01     0.34   0.15  -0.05     0.24   0.05  -0.03
    28   1     0.04  -0.02   0.00     0.24  -0.10   0.00     0.17  -0.18   0.02
    29   1    -0.25   0.51   0.31     0.17   0.20   0.05    -0.01   0.12   0.05
    30   1    -0.08  -0.36   0.07     0.05   0.24  -0.05    -0.03  -0.07   0.01
    31   1    -0.31   0.38  -0.43     0.15   0.16  -0.14    -0.02   0.09  -0.09
                     70                     71                     72
                      A                      A                      A
 Frequencies --   1615.2904              1651.6100              1672.3923
 Red. masses --      6.9900                 5.5257                 6.1270
 Frc consts  --     10.7455                 8.8808                10.0966
 IR Inten    --      5.2068                84.5677                86.9774
 RamAct Fr= 1--     43.8200                35.5708               270.3287
  Dep-P Fr= 1--      0.2360                 0.3805                 0.4233
  Dep-U Fr= 1--      0.3819                 0.5513                 0.5948
 Alpha2 Fr= 1--      0.5399                 0.2821                 1.8388
 Beta2  Fr= 1--      2.7889                 3.2681                26.7978
 AlphaG Fr= 1--      0.3558                -0.0321                -0.3007
 Gamma2 Fr= 1--     -0.5453                 0.4390                -1.1797
 Delta2 Fr= 1--      0.3872                -1.5043                 0.5226
 Raman1 Fr= 1--     175.280                142.283               1081.315
 ROA1   Fr= 1--     -39.960                 -5.997                -96.525
 CID1   Fr= 1--      -0.228                 -0.042                 -0.089
 Raman2 Fr= 1--      33.467                 39.217                321.573
 ROA2   Fr= 1--     -16.185                 22.569                -32.493
 CID2   Fr= 1--      -0.484                  0.575                 -0.101
 Raman3 Fr= 1--      66.934                 78.435                643.146
 ROA3   Fr= 1--     -39.960                 -5.997                -96.525
 CID3   Fr= 1--      -0.597                 -0.076                 -0.150
 RC180  Fr= 1--      -0.236                  0.103                  0.190
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.08  -0.27   0.05    -0.06   0.01   0.00    -0.24   0.09   0.00
     2   6     0.09   0.27  -0.06     0.02  -0.02   0.00     0.23  -0.08  -0.00
     3   6    -0.08   0.17  -0.03     0.22  -0.15   0.01     0.18  -0.09   0.00
     4   6     0.01  -0.23   0.04    -0.19   0.13  -0.01    -0.11   0.06  -0.00
     5   6     0.18   0.13  -0.04     0.23   0.03  -0.02     0.16   0.02  -0.01
     6   6    -0.13  -0.08   0.02    -0.23   0.05   0.01    -0.20   0.07   0.00
     7   6     0.14   0.08  -0.02    -0.20   0.03   0.01     0.27  -0.08  -0.00
     8   1     0.32  -0.03  -0.02    -0.36   0.14   0.00    -0.27   0.14  -0.01
     9   1    -0.21  -0.12   0.03    -0.22  -0.26   0.06    -0.11  -0.15   0.03
    10   1     0.07  -0.19   0.03     0.17  -0.18   0.02     0.22  -0.16   0.01
    11   6     0.01   0.02  -0.00     0.02  -0.02  -0.00     0.01  -0.01  -0.00
    12   6     0.00   0.00  -0.00     0.00   0.00  -0.00     0.00   0.00  -0.00
    13   6    -0.01  -0.00  -0.00    -0.00   0.00   0.01     0.00   0.00   0.00
    14   1    -0.17  -0.04   0.02     0.12   0.02  -0.01     0.05   0.01  -0.00
    15   1    -0.01   0.00   0.02    -0.02  -0.01  -0.00    -0.00  -0.00  -0.00
    16   1    -0.00  -0.02  -0.00     0.00  -0.00   0.03     0.00   0.00   0.01
    17   1     0.02  -0.00  -0.00    -0.02   0.01   0.00    -0.01   0.00   0.00
    18   8     0.01   0.00  -0.00     0.00  -0.00  -0.00    -0.00  -0.00  -0.00
    19   8     0.00   0.00   0.00     0.00  -0.00  -0.00     0.00   0.00  -0.00
    20   1     0.00  -0.00   0.00     0.00   0.01  -0.02     0.01  -0.00  -0.02
    21   6    -0.20  -0.15   0.04     0.22   0.02  -0.02    -0.22  -0.01   0.02
    22   6    -0.03   0.27  -0.05    -0.17   0.13  -0.01     0.14  -0.10   0.01
    23   6     0.09  -0.20   0.03     0.15  -0.12   0.01    -0.20   0.12  -0.01
    24   8     0.03  -0.02   0.00     0.03  -0.01   0.00    -0.01   0.01  -0.00
    25   6    -0.01   0.00   0.00     0.01   0.01  -0.00    -0.01  -0.01   0.00
    26   1    -0.04   0.19  -0.03     0.12  -0.16   0.02    -0.28   0.22  -0.02
    27   1     0.19   0.11  -0.03    -0.19  -0.26   0.06     0.13   0.23  -0.05
    28   1    -0.36   0.02   0.02    -0.26   0.07   0.00     0.31  -0.14   0.00
    29   1     0.01   0.00  -0.00    -0.06  -0.04  -0.01     0.04   0.05   0.02
    30   1    -0.03  -0.05   0.01    -0.02  -0.09   0.02     0.01   0.05  -0.01
    31   1     0.01   0.00   0.00    -0.05  -0.03   0.04     0.03   0.04  -0.04
                     73                     74                     75
                      A                      A                      A
 Frequencies --   1835.7563              3011.0945              3013.7568
 Red. masses --     10.4395                 1.0345                 1.0813
 Frc consts  --     20.7281                 5.5264                 5.7867
 IR Inten    --    408.7640                47.6301                10.7406
 RamAct Fr= 1--     35.6650               229.9464                91.2908
  Dep-P Fr= 1--      0.3149                 0.0709                 0.1367
  Dep-U Fr= 1--      0.4790                 0.1325                 0.2405
 Alpha2 Fr= 1--      0.3497                 4.3201                 1.4594
 Beta2  Fr= 1--      2.8470                 5.0771                 3.6595
 AlphaG Fr= 1--     -1.3610                -0.1433                -0.3345
 Gamma2 Fr= 1--     -6.3886                 0.2879                -3.5231
 Delta2 Fr= 1--      0.4675                 0.3605                -1.7679
 Raman1 Fr= 1--     142.660                919.786                365.163
 ROA1   Fr= 1--    -598.349                 39.175               -394.787
 CID1   Fr= 1--      -4.194                  0.043                 -1.081
 Raman2 Fr= 1--      34.164                 60.926                 43.914
 ROA2   Fr= 1--    -157.067                  4.026                -70.410
 CID2   Fr= 1--      -4.597                  0.066                 -1.603
 Raman3 Fr= 1--      68.328                121.851                 87.829
 ROA3   Fr= 1--    -598.349                 39.175               -394.787
 CID3   Fr= 1--      -8.757                  0.322                 -4.495
 RC180  Fr= 1--      -0.042                 -0.735                 -0.519
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
     2   6    -0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00   0.00  -0.00
     3   6     0.00   0.01   0.00    -0.00   0.00  -0.00    -0.00   0.00   0.00
     4   6    -0.01  -0.02  -0.00     0.00  -0.00   0.00     0.00  -0.00   0.00
     5   6     0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00   0.00  -0.00
     6   6     0.00  -0.00   0.00     0.00  -0.00   0.00     0.00   0.00  -0.00
     7   6     0.00   0.00  -0.00    -0.00   0.00  -0.00     0.00  -0.00   0.00
     8   1    -0.00   0.00  -0.01    -0.00  -0.00   0.00     0.00   0.00  -0.00
     9   1    -0.01  -0.00  -0.00    -0.00   0.00  -0.00     0.01  -0.01   0.00
    10   1    -0.00  -0.00   0.00     0.00   0.00  -0.00     0.00   0.00  -0.00
    11   6    -0.04  -0.03  -0.00     0.00  -0.00   0.00     0.03  -0.07   0.02
    12   6     0.01   0.00  -0.01    -0.00   0.00  -0.00    -0.00   0.01  -0.00
    13   6     0.63   0.37  -0.12    -0.00  -0.00   0.00    -0.00  -0.00   0.00
    14   1    -0.02  -0.01  -0.04    -0.01   0.02  -0.01    -0.33   0.89  -0.27
    15   1     0.01   0.03   0.03     0.00  -0.00   0.00     0.03  -0.08   0.03
    16   1     0.03   0.05   0.04    -0.00   0.00  -0.00     0.01   0.00   0.00
    17   1    -0.07  -0.03   0.09    -0.00   0.00   0.00    -0.01  -0.01  -0.01
    18   8    -0.40  -0.23   0.08     0.00   0.00  -0.00     0.00   0.00  -0.00
    19   8    -0.04  -0.03  -0.02    -0.00  -0.00   0.00     0.00   0.00  -0.00
    20   1    -0.06   0.14   0.42     0.00   0.00  -0.00     0.00  -0.00   0.00
    21   6     0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    22   6    -0.01   0.00  -0.00    -0.00   0.00   0.00     0.00   0.00  -0.00
    23   6     0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
    24   8     0.00   0.00  -0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    25   6    -0.00  -0.00   0.00    -0.00   0.05  -0.01     0.00  -0.00   0.00
    26   1     0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00   0.00  -0.00
    27   1    -0.00  -0.00   0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
    28   1    -0.01   0.00   0.00     0.01   0.02  -0.00    -0.00  -0.00   0.00
    29   1    -0.00   0.00   0.00     0.17  -0.25   0.60    -0.00   0.01  -0.02
    30   1    -0.00  -0.00   0.00    -0.28   0.09   0.00     0.01  -0.00  -0.00
    31   1    -0.00   0.00  -0.00     0.09  -0.45  -0.49    -0.00   0.01   0.01
                     76                     77                     78
                      A                      A                      A
 Frequencies --   3050.6222              3067.6384              3114.0768
 Red. masses --      1.0349                 1.1058                 1.1027
 Frc consts  --      5.6744                 6.1309                 6.3004
 IR Inten    --     16.4755                33.0668                15.9485
 RamAct Fr= 1--    179.0516                58.0276                35.3473
  Dep-P Fr= 1--      0.0296                 0.7499                 0.6547
  Dep-U Fr= 1--      0.0576                 0.8571                 0.7913
 Alpha2 Fr= 1--      3.7116                 0.0001                 0.0603
 Beta2  Fr= 1--      1.7185                 8.2891                 4.6618
 AlphaG Fr= 1--     -0.0801                -0.0691                 0.0098
 Gamma2 Fr= 1--      1.4768                -1.0094                -5.2615
 Delta2 Fr= 1--      3.7553                -0.4787                -1.3814
 Raman1 Fr= 1--     716.206                232.110                141.389
 ROA1   Fr= 1--     261.940               -112.222               -549.309
 CID1   Fr= 1--       0.366                 -0.483                 -3.885
 Raman2 Fr= 1--      20.622                 99.469                 55.942
 ROA2   Fr= 1--       5.400                -20.396               -115.224
 CID2   Fr= 1--       0.262                 -0.205                 -2.060
 Raman3 Fr= 1--      41.244                198.938                111.884
 ROA3   Fr= 1--     261.940               -112.222               -549.309
 CID3   Fr= 1--       6.351                 -0.564                 -4.910
 RC180  Fr= 1--      -0.885                  0.714                  0.583
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.00    -0.00  -0.00  -0.00    -0.00   0.00  -0.00
     2   6     0.00   0.00   0.00    -0.00  -0.00  -0.00    -0.00   0.00   0.00
     3   6     0.00   0.00  -0.00     0.00   0.00   0.00     0.00   0.00  -0.00
     4   6     0.00  -0.00  -0.00    -0.00   0.00  -0.00     0.00   0.00   0.00
     5   6    -0.00   0.00  -0.00     0.00   0.00   0.00    -0.00   0.00  -0.00
     6   6    -0.00  -0.00   0.00     0.00   0.00   0.00     0.00  -0.00   0.00
     7   6     0.00   0.00  -0.00    -0.00  -0.00  -0.00     0.00  -0.00  -0.00
     8   1    -0.00  -0.01   0.00     0.00   0.00  -0.00    -0.02  -0.03   0.01
     9   1     0.00  -0.00   0.00    -0.00  -0.00  -0.00     0.01  -0.01   0.00
    10   1     0.00   0.00  -0.00    -0.00  -0.00  -0.00     0.00   0.00  -0.00
    11   6     0.00  -0.00   0.00    -0.00   0.00  -0.00     0.00  -0.01   0.00
    12   6    -0.00  -0.01   0.05     0.00   0.00  -0.00     0.00  -0.09  -0.01
    13   6    -0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.00  -0.00   0.00
    14   1    -0.01   0.03  -0.01     0.00  -0.00   0.00    -0.03   0.08  -0.03
    15   1    -0.20   0.56  -0.19     0.00  -0.00   0.00    -0.23   0.63  -0.24
    16   1     0.47  -0.01  -0.02    -0.00   0.00   0.00    -0.04  -0.02  -0.00
    17   1    -0.24  -0.45  -0.37     0.00   0.00   0.00     0.27   0.48   0.41
    18   8     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
    19   8     0.00   0.00   0.00    -0.00   0.00   0.00     0.00   0.00  -0.00
    20   1    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00
    21   6    -0.00   0.00   0.00    -0.00  -0.00  -0.00    -0.00  -0.00   0.00
    22   6     0.00  -0.00   0.00     0.00   0.00   0.00    -0.00   0.00  -0.00
    23   6    -0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
    24   8    -0.00   0.00   0.00     0.00   0.00   0.00     0.00   0.00   0.00
    25   6    -0.00   0.00  -0.00    -0.01  -0.02  -0.09     0.00  -0.00  -0.00
    26   1    -0.00  -0.00   0.00     0.00   0.00   0.00    -0.00  -0.00   0.00
    27   1     0.00  -0.00   0.00    -0.00  -0.00  -0.00     0.00  -0.00   0.00
    28   1     0.00   0.00  -0.00     0.00   0.00   0.00    -0.00  -0.00   0.00
    29   1     0.00  -0.00   0.00     0.19  -0.28   0.62    -0.00   0.00  -0.00
    30   1    -0.00   0.00  -0.00    -0.00  -0.00  -0.02    -0.00   0.00   0.00
    31   1     0.00  -0.00  -0.00    -0.11   0.48   0.50    -0.00   0.00   0.00
                     79                     80                     81
                      A                      A                      A
 Frequencies --   3133.1339              3140.1729              3157.1065
 Red. masses --      1.1020                 1.0993                 1.0898
 Frc consts  --      6.3738                 6.3867                 6.3997
 IR Inten    --     17.1214                22.8754                 6.6750
 RamAct Fr= 1--    203.3469               178.0509                44.6985
  Dep-P Fr= 1--      0.4727                 0.4136                 0.3012
  Dep-U Fr= 1--      0.6420                 0.5852                 0.4630
 Alpha2 Fr= 1--      1.1343                 1.2555                 0.4567
 Beta2  Fr= 1--     21.7577                17.3645                 3.4493
 AlphaG Fr= 1--      0.6926                 0.0106                -0.2490
 Gamma2 Fr= 1--      6.7210                -0.4658                 1.0010
 Delta2 Fr= 1--     -1.5083                 0.2297                 1.4908
 Raman1 Fr= 1--     813.388                712.203                178.794
 ROA1   Fr= 1--     596.951                -37.364                143.799
 CID1   Fr= 1--       0.734                 -0.052                  0.804
 Raman2 Fr= 1--     261.092                208.375                 41.391
 ROA2   Fr= 1--     173.371                -13.017                 12.098
 CID2   Fr= 1--       0.664                 -0.062                  0.292
 Raman3 Fr= 1--     522.184                416.749                 82.782
 ROA3   Fr= 1--     596.951                -37.364                143.799
 CID3   Fr= 1--       1.143                 -0.090                  1.737
 RC180  Fr= 1--       0.284                  0.170                 -0.074
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.00   0.00     0.00   0.00  -0.00     0.00  -0.00   0.00
     2   6     0.00  -0.00  -0.00     0.00  -0.00   0.00     0.00   0.00  -0.00
     3   6    -0.00  -0.00   0.00    -0.00  -0.00   0.00    -0.04  -0.07   0.02
     4   6     0.00   0.00  -0.00    -0.00  -0.00  -0.00    -0.00   0.00  -0.00
     5   6     0.00  -0.00   0.00    -0.00   0.00  -0.00     0.00  -0.00  -0.00
     6   6    -0.00   0.00  -0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
     7   6     0.00   0.00  -0.00    -0.00   0.00   0.00     0.00   0.01  -0.00
     8   1     0.01   0.01  -0.00     0.00   0.00  -0.00     0.45   0.86  -0.19
     9   1    -0.00   0.01  -0.00     0.00  -0.00   0.00    -0.01   0.01  -0.00
    10   1    -0.00  -0.00   0.00    -0.00  -0.00   0.00     0.02   0.04  -0.01
    11   6    -0.00   0.00  -0.00     0.00  -0.00   0.00     0.00  -0.00   0.00
    12   6    -0.09   0.00  -0.02     0.00  -0.00   0.00     0.00  -0.00   0.00
    13   6    -0.00  -0.00   0.00     0.00   0.00  -0.00     0.00  -0.00  -0.00
    14   1     0.01  -0.03   0.01    -0.00   0.00  -0.00     0.00   0.00  -0.00
    15   1     0.08  -0.26   0.09    -0.00   0.00  -0.00    -0.01   0.03  -0.01
    16   1     0.88  -0.02  -0.05    -0.00   0.00   0.00    -0.01  -0.00   0.00
    17   1     0.12   0.26   0.21    -0.00  -0.00  -0.00     0.00   0.01   0.01
    18   8     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00   0.00
    19   8     0.00   0.00  -0.00     0.00   0.00  -0.00    -0.00   0.00   0.00
    20   1     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
    21   6    -0.00   0.00  -0.00     0.00   0.00  -0.00     0.00  -0.00   0.00
    22   6     0.00  -0.00  -0.00     0.00   0.00  -0.00     0.00   0.00  -0.00
    23   6    -0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00  -0.00   0.00
    24   8    -0.00  -0.00   0.00    -0.00  -0.00   0.00    -0.00   0.00   0.00
    25   6    -0.00   0.00  -0.00    -0.08   0.04  -0.00     0.00  -0.00  -0.00
    26   1    -0.00  -0.00   0.00    -0.00  -0.00   0.00    -0.04  -0.07   0.02
    27   1     0.00  -0.00   0.00     0.00  -0.00   0.00    -0.01   0.01  -0.00
    28   1     0.00   0.00  -0.00     0.01   0.02  -0.01    -0.00   0.00   0.00
    29   1     0.00  -0.00   0.00     0.04  -0.06   0.18     0.00  -0.00  -0.00
    30   1     0.00  -0.00  -0.00     0.92  -0.27  -0.01    -0.00   0.00   0.00
    31   1     0.00  -0.00  -0.00     0.02  -0.12  -0.15     0.00   0.00   0.00
                     82                     83                     84
                      A                      A                      A
 Frequencies --   3161.5794              3174.9084              3179.2345
 Red. masses --      1.0863                 1.0882                 1.0945
 Frc consts  --      6.3977                 6.4631                 6.5180
 IR Inten    --      4.9885                 6.3767                14.4098
 RamAct Fr= 1--     73.8880                70.8714               171.7294
  Dep-P Fr= 1--      0.6788                 0.5853                 0.1769
  Dep-U Fr= 1--      0.8087                 0.7384                 0.3006
 Alpha2 Fr= 1--      0.0929                 0.2182                 2.4777
 Beta2  Fr= 1--      9.9584                 8.7220                 8.6048
 AlphaG Fr= 1--      0.0842                 0.0024                 0.2694
 Gamma2 Fr= 1--      1.6783                 0.6266                -0.0737
 Delta2 Fr= 1--      0.8736                -0.0927                -0.7287
 Raman1 Fr= 1--     295.552                283.486                686.918
 ROA1   Fr= 1--     189.077                 57.189                -30.398
 CID1   Fr= 1--       0.640                  0.202                 -0.044
 Raman2 Fr= 1--     119.501                104.664                103.258
 ROA2   Fr= 1--      33.292                 15.781                  4.060
 CID2   Fr= 1--       0.279                  0.151                  0.039
 Raman3 Fr= 1--     239.002                209.329                206.516
 ROA3   Fr= 1--     189.077                 57.189                -30.398
 CID3   Fr= 1--       0.791                  0.273                 -0.147
 RC180  Fr= 1--       0.617                  0.477                 -0.399
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00   0.00    -0.00   0.00  -0.00     0.00   0.00  -0.00
     2   6     0.00  -0.00  -0.00     0.00   0.00  -0.00    -0.00   0.00  -0.00
     3   6    -0.00  -0.00   0.00    -0.00  -0.01   0.00     0.00   0.00  -0.00
     4   6     0.00   0.00  -0.00     0.00   0.00  -0.00     0.00   0.00  -0.00
     5   6     0.03  -0.06   0.01     0.00  -0.00   0.00     0.03  -0.05   0.01
     6   6     0.02   0.05  -0.01    -0.00  -0.00   0.00    -0.03  -0.06   0.01
     7   6     0.00   0.00  -0.00    -0.04  -0.07   0.02     0.00   0.00  -0.00
     8   1     0.01   0.01  -0.00     0.04   0.07  -0.02    -0.02  -0.04   0.01
     9   1    -0.41   0.65  -0.09    -0.01   0.02  -0.00    -0.33   0.52  -0.07
    10   1    -0.28  -0.54   0.12     0.01   0.02  -0.00     0.36   0.67  -0.15
    11   6     0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00  -0.00   0.00
    12   6     0.00  -0.00   0.00     0.00  -0.00   0.00     0.00  -0.00  -0.00
    13   6    -0.00   0.00  -0.00    -0.00  -0.00  -0.00    -0.00   0.00   0.00
    14   1    -0.01   0.01  -0.00    -0.00   0.00  -0.00    -0.01   0.01  -0.00
    15   1    -0.00   0.01  -0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
    16   1    -0.01   0.00   0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
    17   1     0.00   0.00   0.00     0.00   0.00   0.00     0.00   0.00   0.00
    18   8     0.00  -0.00   0.00     0.00   0.00   0.00    -0.00  -0.00  -0.00
    19   8     0.00   0.00   0.00    -0.00   0.00   0.00     0.00   0.00  -0.00
    20   1    -0.00  -0.00   0.00     0.00  -0.00  -0.00    -0.00  -0.00   0.00
    21   6     0.00  -0.00   0.00    -0.01   0.02  -0.00     0.00  -0.00   0.00
    22   6    -0.00   0.00  -0.00    -0.00   0.00  -0.00     0.00  -0.00   0.00
    23   6    -0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
    24   8     0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
    25   6    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00   0.00   0.00
    26   1    -0.00  -0.01   0.00     0.43   0.81  -0.18    -0.01  -0.02   0.00
    27   1    -0.00   0.00  -0.00     0.18  -0.28   0.04    -0.01   0.01  -0.00
    28   1     0.01   0.02  -0.00     0.01   0.02  -0.00    -0.02  -0.04   0.01
    29   1    -0.00   0.00  -0.00     0.00  -0.00   0.00     0.00  -0.00   0.00
    30   1     0.00  -0.00  -0.00    -0.00   0.00  -0.00     0.00  -0.00  -0.00
    31   1    -0.00   0.00   0.00    -0.00  -0.00  -0.00     0.00  -0.00  -0.00
                     85                     86                     87
                      A                      A                      A
 Frequencies --   3200.3067              3206.0031              3715.3566
 Red. masses --      1.0939                 1.0892                 1.0650
 Frc consts  --      6.6013                 6.5963                 8.6619
 IR Inten    --      4.7939                 8.9580               134.5524
 RamAct Fr= 1--    203.2247                86.6232               225.9897
  Dep-P Fr= 1--      0.2203                 0.2649                 0.2268
  Dep-U Fr= 1--      0.3611                 0.4189                 0.3698
 Alpha2 Fr= 1--      2.6135                 0.9843                 2.8553
 Beta2  Fr= 1--     12.2313                 6.0473                13.9287
 AlphaG Fr= 1--      0.0232                -0.0188                -3.8637
 Gamma2 Fr= 1--     -0.2757                -0.3235               -45.2401
 Delta2 Fr= 1--      0.5553                -0.0267                 0.7778
 Raman1 Fr= 1--     812.899                346.493                903.959
 ROA1   Fr= 1--      -8.701                -31.910              -4318.157
 CID1   Fr= 1--      -0.011                 -0.092                 -4.777
 Raman2 Fr= 1--     146.775                 72.567                167.144
 ROA2   Fr= 1--     -11.060                 -7.550              -1091.983
 CID2   Fr= 1--      -0.075                 -0.104                 -6.533
 Raman3 Fr= 1--     293.550                145.135                334.288
 ROA3   Fr= 1--      -8.701                -31.910              -4318.157
 CID3   Fr= 1--      -0.030                 -0.220                -12.917
 RC180  Fr= 1--      -0.278                 -0.162                 -0.260
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.00     0.00   0.00  -0.00     0.00   0.00  -0.00
     2   6     0.00   0.00  -0.00     0.00  -0.00   0.00    -0.00  -0.00  -0.00
     3   6    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00   0.00  -0.00
     4   6     0.00   0.00   0.00     0.00   0.00  -0.00     0.00  -0.00   0.00
     5   6    -0.00   0.00  -0.00     0.00  -0.00   0.00    -0.00  -0.00   0.00
     6   6     0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00  -0.00   0.00
     7   6    -0.02  -0.02   0.01     0.00   0.00  -0.00    -0.00   0.00  -0.00
     8   1     0.01   0.01  -0.00    -0.00  -0.00   0.00    -0.00  -0.00   0.00
     9   1     0.00  -0.00   0.00    -0.01   0.01  -0.00    -0.00   0.00  -0.00
    10   1    -0.00  -0.00   0.00     0.02   0.05  -0.01     0.00   0.00  -0.00
    11   6    -0.00   0.00  -0.00     0.00  -0.00   0.00     0.00  -0.00  -0.00
    12   6    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    13   6    -0.00  -0.00  -0.00     0.00   0.00   0.00    -0.00  -0.00   0.00
    14   1     0.00  -0.00   0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
    15   1    -0.00   0.00  -0.00     0.00  -0.00   0.00    -0.00   0.00  -0.00
    16   1     0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00   0.00   0.00
    17   1     0.00   0.00   0.00     0.00   0.00  -0.00     0.00  -0.00  -0.00
    18   8     0.00   0.00   0.00    -0.00  -0.00  -0.00     0.00   0.00  -0.00
    19   8    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.06  -0.03   0.00
    20   1     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.89   0.45  -0.02
    21   6     0.05  -0.07   0.01     0.00  -0.00   0.00     0.00   0.00  -0.00
    22   6     0.00   0.00  -0.00    -0.00   0.00  -0.00    -0.00   0.00   0.00
    23   6    -0.00   0.00  -0.00    -0.04  -0.08   0.02     0.00  -0.00   0.00
    24   8    -0.00  -0.00   0.00     0.00  -0.00   0.00     0.00   0.00  -0.00
    25   6    -0.00   0.00   0.00     0.00  -0.00   0.00    -0.00  -0.00   0.00
    26   1     0.16   0.28  -0.06    -0.01  -0.02   0.00    -0.00  -0.00   0.00
    27   1    -0.52   0.78  -0.10    -0.01   0.01  -0.00     0.00  -0.00  -0.00
    28   1    -0.00  -0.01   0.00     0.45   0.86  -0.19     0.00   0.00  -0.00
    29   1     0.00   0.00  -0.00    -0.01   0.01  -0.02    -0.00   0.00  -0.00
    30   1     0.00  -0.00   0.00    -0.02   0.01  -0.00     0.00  -0.00  -0.00
    31   1     0.00   0.00   0.00    -0.00   0.01   0.02    -0.00   0.00   0.00

 -------------------
 - Thermochemistry -
 -------------------
 Temperature   298.150 Kelvin.  Pressure   1.00000 Atm.
 Atom     1 has atomic number  6 and mass  12.00000
 Atom     2 has atomic number  6 and mass  12.00000
 Atom     3 has atomic number  6 and mass  12.00000
 Atom     4 has atomic number  6 and mass  12.00000
 Atom     5 has atomic number  6 and mass  12.00000
 Atom     6 has atomic number  6 and mass  12.00000
 Atom     7 has atomic number  6 and mass  12.00000
 Atom     8 has atomic number  1 and mass   1.00783
 Atom     9 has atomic number  1 and mass   1.00783
 Atom    10 has atomic number  1 and mass   1.00783
 Atom    11 has atomic number  6 and mass  12.00000
 Atom    12 has atomic number  6 and mass  12.00000
 Atom    13 has atomic number  6 and mass  12.00000
 Atom    14 has atomic number  1 and mass   1.00783
 Atom    15 has atomic number  1 and mass   1.00783
 Atom    16 has atomic number  1 and mass   1.00783
 Atom    17 has atomic number  1 and mass   1.00783
 Atom    18 has atomic number  8 and mass  15.99491
 Atom    19 has atomic number  8 and mass  15.99491
 Atom    20 has atomic number  1 and mass   1.00783
 Atom    21 has atomic number  6 and mass  12.00000
 Atom    22 has atomic number  6 and mass  12.00000
 Atom    23 has atomic number  6 and mass  12.00000
 Atom    24 has atomic number  8 and mass  15.99491
 Atom    25 has atomic number  6 and mass  12.00000
 Atom    26 has atomic number  1 and mass   1.00783
 Atom    27 has atomic number  1 and mass   1.00783
 Atom    28 has atomic number  1 and mass   1.00783
 Atom    29 has atomic number  1 and mass   1.00783
 Atom    30 has atomic number  1 and mass   1.00783
 Atom    31 has atomic number  1 and mass   1.00783
 Molecular mass:   230.09429 amu.
 Principal axes and moments of inertia in atomic units:
                           1         2         3
     Eigenvalues --  1362.007688565.053429014.99569
           X            0.99993   0.00039  -0.01150
           Y           -0.00077   0.99945  -0.03303
           Z            0.01148   0.03303   0.99939
 This molecule is an asymmetric top.
 Rotational symmetry number  1.
 Warning -- assumption of classical behavior for rotation
           may cause significant error
 Rotational temperatures (Kelvin)      0.06359     0.01011     0.00961
 Rotational constants (GHZ):           1.32506     0.21071     0.20019
 Zero-point vibrational energy     657833.2 (Joules/Mol)
                                  157.22591 (Kcal/Mol)
 Warning -- explicit consideration of  24 degrees of freedom as
           vibrations may cause significant error
 Vibrational temperatures:     30.12    44.58    66.74   130.44   174.33
          (Kelvin)            207.38   262.16   270.99   314.24   332.36
                              372.80   412.80   477.38   516.40   576.87
                              596.47   669.91   693.32   699.45   733.35
                              768.12   777.40   831.97   869.30   915.15
                              990.82   999.58  1063.53  1119.84  1129.57
                             1180.38  1199.57  1208.91  1246.18  1267.75
                             1334.25  1363.88  1383.34  1394.61  1413.22
                             1480.52  1527.51  1570.54  1581.08  1657.07
                             1689.08  1691.43  1697.13  1718.83  1725.13
                             1758.37  1793.87  1863.03  1867.69  1874.72
                             1904.27  1922.09  1994.12  2014.79  2036.33
                             2052.94  2096.23  2123.89  2147.34  2148.31
                             2153.99  2166.87  2193.96  2226.16  2324.04
                             2376.30  2406.20  2641.24  4332.29  4336.12
                             4389.16  4413.65  4480.46  4507.88  4518.01
                             4542.37  4548.81  4567.99  4574.21  4604.53
                             4612.72  5345.57
 
 Zero-point correction=                           0.250555 (Hartree/Particle)
 Thermal correction to Energy=                    0.265801
 Thermal correction to Enthalpy=                  0.266745
 Thermal correction to Gibbs Free Energy=         0.206535
 Sum of electronic and zero-point Energies=           -767.721876
 Sum of electronic and thermal Energies=              -767.706630
 Sum of electronic and thermal Enthalpies=            -767.705686
 Sum of electronic and thermal Free Energies=         -767.765896
 
                     E (Thermal)             CV                S
                      KCal/Mol        Cal/Mol-Kelvin    Cal/Mol-Kelvin
 Total                  166.793             58.690            126.722
 Electronic               0.000              0.000              0.000
 Translational            0.889              2.981             42.202
 Rotational               0.889              2.981             33.019
 Vibrational            165.015             52.728             51.501
 Vibration     1          0.593              1.986              6.544
 Vibration     2          0.594              1.984              5.766
 Vibration     3          0.595              1.979              4.966
 Vibration     4          0.602              1.956              3.646
 Vibration     5          0.609              1.932              3.082
 Vibration     6          0.616              1.909              2.748
 Vibration     7          0.630              1.864              2.306
 Vibration     8          0.633              1.856              2.244
 Vibration     9          0.646              1.813              1.972
 Vibration    10          0.653              1.794              1.871
 Vibration    11          0.668              1.747              1.668
 Vibration    12          0.684              1.698              1.492
 Vibration    13          0.714              1.612              1.251
 Vibration    14          0.734              1.557              1.127
 Vibration    15          0.767              1.468              0.959
 Vibration    16          0.778              1.439              0.911
 Vibration    17          0.823              1.326              0.750
 Vibration    18          0.838              1.290              0.705
 Vibration    19          0.842              1.281              0.694
 Vibration    20          0.865              1.228              0.634
 Vibration    21          0.889              1.175              0.579
 Vibration    22          0.895              1.161              0.565
 Vibration    23          0.935              1.078              0.489
 Vibration    24          0.963              1.023              0.443
                       Q            Log10(Q)             Ln(Q)
 Total Bot       0.100089D-94        -94.999612       -218.744691
 Total V=0       0.176923D+21         20.247783         46.622244
 Vib (Bot)       0.198743-109       -109.701708       -252.597518
 Vib (Bot)    1  0.989514D+01          0.995422          2.292044
 Vib (Bot)    2  0.668240D+01          0.824933          1.899477
 Vib (Bot)    3  0.445830D+01          0.649170          1.494768
 Vib (Bot)    4  0.226757D+01          0.355560          0.818708
 Vib (Bot)    5  0.168618D+01          0.226905          0.522467
 Vib (Bot)    6  0.140915D+01          0.148957          0.342986
 Vib (Bot)    7  0.110147D+01          0.041973          0.096646
 Vib (Bot)    8  0.106325D+01          0.026637          0.061333
 Vib (Bot)    9  0.906260D+00         -0.042747         -0.098429
 Vib (Bot)   10  0.852239D+00         -0.069439         -0.159888
 Vib (Bot)   11  0.749938D+00         -0.124975         -0.287765
 Vib (Bot)   12  0.667639D+00         -0.175459         -0.404008
 Vib (Bot)   13  0.562518D+00         -0.249863         -0.575332
 Vib (Bot)   14  0.511049D+00         -0.291537         -0.671289
 Vib (Bot)   15  0.444234D+00         -0.352388         -0.811403
 Vib (Bot)   16  0.425296D+00         -0.371309         -0.854970
 Vib (Bot)   17  0.363603D+00         -0.439372         -1.011691
 Vib (Bot)   18  0.346509D+00         -0.460286         -1.059848
 Vib (Bot)   19  0.342211D+00         -0.465706         -1.072327
 Vib (Bot)   20  0.319660D+00         -0.495311         -1.140496
 Vib (Bot)   21  0.298484D+00         -0.525079         -1.209040
 Vib (Bot)   22  0.293137D+00         -0.532930         -1.227116
 Vib (Bot)   23  0.263988D+00         -0.578416         -1.331852
 Vib (Bot)   24  0.246073D+00         -0.608936         -1.402126
 Vib (V=0)       0.351308D+06          5.545687         12.769417
 Vib (V=0)    1  0.104078D+02          1.017357          2.342552
 Vib (V=0)    2  0.720108D+01          0.857398          1.974231
 Vib (V=0)    3  0.498625D+01          0.697774          1.606685
 Vib (V=0)    4  0.282204D+01          0.450563          1.037460
 Vib (V=0)    5  0.225875D+01          0.353869          0.814813
 Vib (V=0)    6  0.199523D+01          0.299992          0.690757
 Vib (V=0)    7  0.170964D+01          0.232906          0.536285
 Vib (V=0)    8  0.167495D+01          0.224002          0.515783
 Vib (V=0)    9  0.153504D+01          0.186120          0.428556
 Vib (V=0)   10  0.148808D+01          0.172628          0.397490
 Vib (V=0)   11  0.140134D+01          0.146542          0.337426
 Vib (V=0)   12  0.133411D+01          0.125192          0.288265
 Vib (V=0)   13  0.125261D+01          0.097817          0.225232
 Vib (V=0)   14  0.121496D+01          0.084563          0.194713
 Vib (V=0)   15  0.116884D+01          0.067754          0.156010
 Vib (V=0)   16  0.115641D+01          0.063113          0.145322
 Vib (V=0)   17  0.111823D+01          0.048531          0.111746
 Vib (V=0)   18  0.110833D+01          0.044670          0.102856
 Vib (V=0)   19  0.110589D+01          0.043714          0.100655
 Vib (V=0)   20  0.109345D+01          0.038799          0.089338
 Vib (V=0)   21  0.108232D+01          0.034354          0.079104
 Vib (V=0)   22  0.107959D+01          0.033260          0.076585
 Vib (V=0)   23  0.106541D+01          0.027517          0.063361
 Vib (V=0)   24  0.105727D+01          0.024187          0.055692
 Electronic      0.100000D+01          0.000000          0.000000
 Translational   0.137187D+09          8.137313         18.736855
 Rotational      0.367099D+07          6.564783         15.115972
 
                                                          ROA calculations.
                                                             IR Spectrum
 
     3            3333333333333                             111111111111111111111111111111111                                        
     7            2211111110000                             866655544444444333322221111110000999998888877766665555444443322221111    
     1            0077654316511                             3751420999752108320994299877599628664286432873983074318861053853188429432
     5            6095270348141                             6225756732677506643857295064292292918716040589596480406265192791882411611
 
     X            XXXXXXXXXXXXX                             XXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXXX
     X                     X  X                             XXX  XX     X   X XXXX    X    X      X           X                      
     X                                                      XXX  X      X   X  XXX         X                                         
     X                                                      XXX         X   X  XXX                                                   
     X                                                      X               X  XXX                                                   
     X                                                      X               X  XXX                                                   
     X                                                      X               X  X X                                                   
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
                                                            X                                                                        
 
 ***** Axes restored to original set *****
 -------------------------------------------------------------------
 Center     Atomic                   Forces (Hartrees/Bohr)
 Number     Number              X              Y              Z
 -------------------------------------------------------------------
      1        6          -0.000002741    0.000003986   -0.000001464
      2        6          -0.000006029    0.000000575    0.000000669
      3        6           0.000006321    0.000003576    0.000003242
      4        6           0.000004593   -0.000009776   -0.000000919
      5        6          -0.000004242    0.000000805    0.000001953
      6        6           0.000006877    0.000000063   -0.000000546
      7        6           0.000006975   -0.000003671   -0.000000612
      8        1          -0.000000070   -0.000001242   -0.000001156
      9        1           0.000001020    0.000000742   -0.000001219
     10        1          -0.000001695    0.000000871   -0.000000588
     11        6          -0.000016424   -0.000003783    0.000013757
     12        6          -0.000008382   -0.000000266   -0.000015311
     13        6           0.000035952    0.000008978   -0.000031247
     14        1           0.000000527    0.000002278   -0.000002293
     15        1           0.000005772   -0.000000656    0.000003258
     16        1           0.000000724    0.000001247   -0.000005115
     17        1           0.000003755   -0.000000511   -0.000000968
     18        8          -0.000021143   -0.000009846    0.000008178
     19        8          -0.000012453    0.000004106    0.000027311
     20        1          -0.000000330    0.000000848   -0.000003207
     21        6           0.000001932   -0.000006432    0.000002697
     22        6          -0.000016271    0.000012808    0.000004250
     23        6           0.000022271   -0.000010195   -0.000000666
     24        8           0.000017930    0.000017841   -0.000011625
     25        6          -0.000032317   -0.000031672    0.000012631
     26        1          -0.000001233    0.000000018    0.000000455
     27        1           0.000000094    0.000001054    0.000000761
     28        1           0.000007847    0.000004028   -0.000001140
     29        1           0.000000629    0.000005584   -0.000002903
     30        1           0.000001229    0.000001491    0.000001260
     31        1          -0.000001116    0.000007152    0.000000561
 -------------------------------------------------------------------
 Cartesian Forces:  Max     0.000035952 RMS     0.000010061
 End of FrcOut F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) frequency  1    0.088559:
                 1             2             3 
      1   0.303178D+03 -0.125945D+02 -0.102746D+02
      2  -0.125945D+02  0.177410D+03 -0.850368D+01
      3  -0.102746D+02 -0.850368D+01  0.120356D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.088559:
                 1             2             3 
      1  -0.111415D+02  0.194338D+02 -0.152319D+02
      2  -0.264150D+02 -0.132530D+02 -0.312428D+02
      3   0.499098D+02 -0.586642D+02  0.215607D+02
 Property number 4 -- D-Q polarizability frequency  1    0.088559:
                 1             2             3 
      1   0.333339D+03 -0.957881D+02 -0.139768D+02
      2  -0.146176D+03  0.769781D+02 -0.115842D+02
      3  -0.187163D+03  0.188100D+02  0.255610D+02
      4  -0.190629D+02  0.123732D+03 -0.444837D+02
      5   0.465371D+02 -0.531838D+02 -0.656365D+02
      6  -0.262387D+02  0.405523D+02  0.247900D+02
 End of FrcOut F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    93 ND12= 1 LenFil=    3351:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.383744D+02  0.715836D+01  0.639873D+00 -0.353646D+02  0.106218D+02
      2   0.715836D+01 -0.338920D+01  0.867179D-01  0.106218D+02 -0.105763D+02
      3   0.639873D+00  0.867179D-01  0.110648D+00  0.145251D+00  0.114332D+01
                 6             7             8             9            10 
      1   0.145251D+00  0.941777D+01 -0.270299D+01 -0.799103D+00  0.466665D+02
      2   0.114332D+01 -0.270299D+01  0.175346D+01 -0.121312D+01 -0.103133D+02
      3   0.100254D+00 -0.799103D+00 -0.121312D+01  0.551895D+00 -0.733381D+00
                11            12            13            14            15 
      1  -0.103133D+02 -0.733381D+00  0.325231D+02 -0.888950D+01 -0.867073D-01
      2   0.696838D+01 -0.680623D+00 -0.888950D+01  0.853584D+01 -0.839936D+00
      3  -0.680623D+00 -0.146941D+00 -0.867073D-01 -0.839936D+00 -0.577068D-01
                16            17            18            19            20 
      1  -0.907375D+01  0.263758D+01  0.148025D+01  0.365638D+02 -0.740524D+01
      2   0.263758D+01 -0.174084D+01  0.958607D+00 -0.740524D+01  0.499295D+01
      3   0.148025D+01  0.958607D+00 -0.314372D+00 -0.284261D+00 -0.580804D+00
                21            22            23            24            25 
      1  -0.284261D+00 -0.281000D+02  0.428296D+01 -0.217916D+00  0.392940D+01
      2  -0.580804D+00  0.428296D+01 -0.558906D+01 -0.183052D+00 -0.854122D+00
      3   0.287781D+00 -0.217916D+00 -0.183052D+00 -0.189996D+01 -0.123135D+01
                26            27            28            29            30 
      1  -0.854122D+00 -0.123135D+01 -0.521906D+02  0.635133D+01  0.670632D+00
      2  -0.359253D+00 -0.288019D+01  0.635133D+01 -0.348457D+01 -0.244817D+00
      3  -0.288019D+01  0.174809D+01  0.670632D+00 -0.244817D+00 -0.223939D+01
                31            32            33            34            35 
      1   0.135273D+02 -0.192604D+01 -0.129379D+01 -0.442636D+01 -0.795467D+00
      2  -0.192604D+01  0.967941D+01 -0.139846D+01 -0.795467D+00 -0.871897D+00
      3  -0.129379D+01 -0.139846D+01  0.473649D+00 -0.671966D+01  0.118835D+01
                36            37            38            39            40 
      1  -0.671966D+01  0.183394D+01 -0.545603D+00  0.147307D+00  0.134128D+02
      2   0.118835D+01 -0.545603D+00 -0.980270D+01  0.168195D+01 -0.223751D+01
      3   0.383876D+00  0.147307D+00  0.168195D+01 -0.171137D+01 -0.618339D+00
                41            42            43            44            45 
      1  -0.223751D+01 -0.618339D+00 -0.319792D+01 -0.321576D+00 -0.504579D+01
      2  -0.116360D+01  0.132667D+01 -0.321576D+00  0.223504D+01  0.326573D+01
      3   0.132667D+01  0.153357D+01 -0.504579D+01  0.326573D+01 -0.875367D+00
                46            47            48            49            50 
      1   0.390083D+01 -0.159304D+01  0.107436D+00  0.285430D+01 -0.242416D+01
      2  -0.159304D+01  0.769875D+01 -0.596815D+00 -0.242416D+01  0.227435D+00
      3   0.107436D+00 -0.596815D+00  0.167828D+01  0.627391D+00  0.104748D+01
                51            52            53            54            55 
      1   0.627391D+00 -0.419973D+00  0.846491D+00  0.110618D+01 -0.111756D+02
      2   0.104748D+01  0.846491D+00  0.969384D+00  0.379934D+01  0.427010D+01
      3   0.742214D+00  0.110618D+01  0.379934D+01 -0.181821D+01 -0.198886D+00
                56            57            58            59            60 
      1   0.427010D+01 -0.198886D+00  0.222709D+01  0.119516D+00 -0.670277D+00
      2  -0.104479D+02  0.116333D+01  0.119516D+00  0.129791D+01 -0.115433D+01
      3   0.116333D+01 -0.166930D+01 -0.670277D+00 -0.115433D+01 -0.777561D+00
                61            62            63            64            65 
      1  -0.552853D-01 -0.912404D+00 -0.149086D+01 -0.244762D+01 -0.237245D+01
      2  -0.912404D+00 -0.824048D+00 -0.345681D+01 -0.237245D+01 -0.143679D+01
      3  -0.149086D+01 -0.345681D+01  0.193674D+01  0.583656D+00  0.330528D+00
                66            67            68            69            70 
      1   0.583656D+00 -0.322811D+01 -0.301892D+01  0.778436D+00  0.927577D+00
      2   0.330528D+00 -0.301892D+01 -0.504121D+01  0.102464D+01  0.727497D+00
      3  -0.440195D+00  0.778436D+00  0.102464D+01 -0.937312D+00 -0.209127D+00
                71            72            73            74            75 
      1   0.727497D+00 -0.209127D+00 -0.457032D+01  0.326814D+01 -0.247591D+00
      2   0.956937D+00 -0.337411D+00  0.326814D+01 -0.346171D+01  0.357772D+00
      3  -0.337411D+00  0.253822D+00 -0.247591D+00  0.357772D+00 -0.331532D+00
                76            77            78            79            80 
      1   0.359676D+01 -0.468597D+01  0.675828D+00 -0.313289D+00  0.743954D+00
      2  -0.468597D+01  0.800758D+01 -0.909556D+00  0.743954D+00 -0.113161D+01
      3   0.675828D+00 -0.909556D+00  0.808297D+00  0.357774D+00  0.343027D+00
                81            82            83            84            85 
      1   0.357774D+00  0.159685D+01  0.222260D+01 -0.481666D+00  0.117941D+01
      2   0.343027D+00  0.222260D+01  0.326876D+01 -0.665411D+00  0.251144D+01
      3  -0.226700D+00 -0.481666D+00 -0.665411D+00  0.434375D+00 -0.438528D+00
                86            87            88            89            90 
      1   0.251144D+01 -0.438528D+00 -0.232597D+00 -0.524391D+00  0.248657D+00
      2   0.916812D+01 -0.163783D+01 -0.524391D+00 -0.188438D+01  0.478062D+00
      3  -0.163783D+01  0.108617D+01  0.248657D+00  0.478062D+00 -0.299190D+00
                91            92            93            94            95 
      1   0.192773D+02 -0.190273D+01  0.291446D+00  0.579630D+01  0.875788D+00
      2  -0.190273D+01  0.170191D+01  0.736658D+00  0.875788D+00 -0.359892D+01
      3   0.291446D+00  0.736658D+00  0.311476D+01  0.436330D+00  0.183532D+01
                96            97            98            99           100 
      1   0.436330D+00 -0.243238D+01  0.142257D+01  0.842470D+01  0.942805D+01
      2   0.183532D+01  0.142257D+01  0.167212D+01 -0.930056D-01 -0.702894D+00
      3   0.118988D+01  0.842470D+01 -0.930056D-01 -0.166346D+01 -0.213403D+01
               101           102           103           104           105 
      1  -0.702894D+00 -0.213403D+01 -0.288970D+01 -0.160394D+01 -0.108510D+00
      2  -0.169338D+01 -0.542344D+00 -0.160394D+01  0.139870D+01 -0.355661D+01
      3  -0.542344D+00 -0.241006D+01 -0.108510D+00 -0.355661D+01 -0.155560D+01
               106           107           108           109           110 
      1   0.660288D+01 -0.105764D+01 -0.559574D+01  0.706796D+01  0.374881D+01
      2  -0.105764D+01 -0.235139D+01 -0.660418D+00  0.374881D+01  0.128547D+01
      3  -0.559574D+01 -0.660418D+00  0.269831D+01 -0.109536D+01 -0.276710D+00
               111           112           113           114           115 
      1  -0.109536D+01  0.832477D+00  0.146261D+01 -0.817001D+00 -0.981006D+01
      2  -0.276710D+00  0.146261D+01  0.654292D+00 -0.829747D+00 -0.146647D+01
      3  -0.102388D+01 -0.817001D+00 -0.829747D+00 -0.281410D+00 -0.444482D+01
               116           117           118           119           120 
      1  -0.146647D+01 -0.444482D+01 -0.521970D+00  0.211508D+01 -0.639597D+00
      2  -0.160187D+01 -0.109412D+00  0.211508D+01 -0.187844D+01  0.203561D-01
      3  -0.109412D+00  0.302193D+00 -0.639597D+00  0.203561D-01 -0.117826D+01
               121           122           123           124           125 
      1   0.429163D+01 -0.227827D+01  0.195818D+00 -0.125362D+01  0.149897D+00
      2  -0.227827D+01  0.601336D+01 -0.950107D+00  0.149897D+00 -0.132708D+01
      3   0.195818D+00 -0.950107D+00  0.137780D+01 -0.147239D+01  0.107524D+01
               126           127           128           129           130 
      1  -0.147239D+01  0.108829D+00 -0.641012D+00  0.171983D+00 -0.195822D+01
      2   0.107524D+01 -0.641012D+00  0.755946D+00 -0.262524D+00  0.235032D-01
      3  -0.426834D+00  0.171983D+00 -0.262524D+00  0.125503D+01  0.592389D+00
               131           132           133           134           135 
      1   0.235032D-01  0.592389D+00  0.203448D+00  0.113280D+00  0.241628D+00
      2  -0.397830D+01  0.222669D+01  0.113280D+00  0.154137D+01 -0.122795D+01
      3   0.222669D+01 -0.262728D+01  0.241628D+00 -0.122795D+01  0.181100D+01
               136           137           138           139           140 
      1  -0.163787D+02  0.847423D+00  0.395162D+01  0.477800D+00 -0.124959D+01
      2   0.847423D+00 -0.858932D+00 -0.308247D+00 -0.124959D+01  0.673802D-01
      3   0.395162D+01 -0.308247D+00 -0.247927D+01 -0.262306D+00  0.708985D+00
               141           142           143           144           145 
      1  -0.262306D+00  0.121994D+01  0.980015D-01 -0.122573D+01 -0.205015D+00
      2   0.708985D+00  0.980015D-01  0.100885D+00  0.107169D+00  0.813977D+00
      3   0.186711D+00 -0.122573D+01  0.107169D+00  0.373712D+00  0.769392D+00
               146           147           148           149           150 
      1   0.813977D+00  0.769392D+00  0.140837D+01  0.132483D+00 -0.280998D+00
      2   0.100120D+01  0.829524D+00  0.132483D+00  0.303760D+01  0.284810D+01
      3   0.829524D+00  0.200701D+01 -0.280998D+00  0.284810D+01  0.361514D+01
               151           152           153           154           155 
      1   0.542689D-01  0.587968D-01  0.266049D+00 -0.183234D+02 -0.466503D+01
      2   0.587968D-01  0.207617D+01  0.236699D+01 -0.466503D+01 -0.269885D+01
      3   0.266049D+00  0.236699D+01  0.444573D+01  0.405936D+00 -0.380449D+00
               156           157           158           159           160 
      1   0.405936D+00 -0.820247D+01 -0.551576D+01  0.264602D+00  0.872359D+00
      2  -0.380449D+00 -0.551576D+01 -0.406272D+01  0.308242D+00  0.507958D+00
      3  -0.266201D+01  0.264602D+00  0.308242D+00 -0.128671D+01 -0.221851D+01
               161           162           163           164           165 
      1   0.507958D+00 -0.221851D+01 -0.139115D+02 -0.285584D+01 -0.354575D+01
      2   0.973345D+00 -0.100032D+01 -0.285584D+01 -0.338324D+00  0.545982D-01
      3  -0.100032D+01  0.128158D+01 -0.354575D+01  0.545982D-01 -0.135141D+01
               166           167           168           169           170 
      1  -0.700119D+01 -0.861054D+00 -0.110532D+01  0.147371D+01  0.312091D+00
      2  -0.861054D+00 -0.850197D+00 -0.167973D+01  0.312091D+00 -0.306719D+00
      3  -0.110532D+01 -0.167973D+01 -0.209876D+01 -0.654133D+00 -0.106295D+01
               171           172           173           174           175 
      1  -0.654133D+00  0.113140D+02  0.235453D+01  0.157830D+01  0.785898D+01
      2  -0.106295D+01  0.235453D+01  0.648236D+00  0.402330D+00  0.870051D+00
      3  -0.718592D+01  0.157830D+01  0.402330D+00  0.301126D+01  0.139610D+01
               176           177           178           179           180 
      1   0.870051D+00  0.139610D+01  0.490217D+01  0.488498D+00  0.198265D+01
      2   0.384899D+00 -0.530814D+00  0.488498D+00 -0.915109D+00  0.522086D+00
      3  -0.530814D+00  0.155425D+01  0.198265D+01  0.522086D+00 -0.119512D+01
               181           182           183           184           185 
      1   0.107172D+02 -0.135985D+01 -0.808407D-01 -0.905644D+01  0.203028D+01
      2  -0.135985D+01  0.109681D+02 -0.200685D+01  0.203028D+01  0.272849D+01
      3  -0.808407D-01 -0.200685D+01  0.194344D+01  0.928606D+00 -0.159000D+01
               186           187           188           189           190 
      1   0.928606D+00  0.148235D+01  0.310000D+00  0.449486D+01  0.316669D+02
      2  -0.159000D+01  0.310000D+00 -0.264698D+01 -0.326438D+01 -0.542492D+01
      3  -0.103974D+01  0.449486D+01 -0.326438D+01  0.794240D+00 -0.312109D+00
               191           192           193           194           195 
      1  -0.542492D+01 -0.312109D+00 -0.211666D+02  0.254042D+01  0.198542D+01
      2   0.566802D+01 -0.322706D+00  0.254042D+01 -0.140419D+02  0.205267D+01
      3  -0.322706D+00  0.271656D+01  0.198542D+01  0.205267D+01 -0.140704D+01
               196           197           198           199           200 
      1   0.257369D+01  0.994624D+00  0.631136D+01 -0.380524D+02  0.917054D+01
      2   0.994624D+00  0.153678D+01 -0.209093D+01  0.917054D+01 -0.844528D+01
      3   0.631136D+01 -0.209093D+01 -0.134882D+00  0.605230D+00  0.135230D+01
               201           202           203           204           205 
      1   0.605230D+00  0.253231D+02 -0.333396D+01 -0.691855D+00 -0.186363D+01
      2   0.135230D+01 -0.333396D+01  0.716994D+01 -0.694017D-01  0.339953D+00
      3  -0.934528D-01 -0.691855D+00 -0.694017D-01  0.212070D+01  0.591188D+00
               206           207           208           209           210 
      1   0.339953D+00  0.591188D+00 -0.449447D+01 -0.410748D-01  0.305459D+00
      2   0.647480D+00  0.350686D+01 -0.410748D-01 -0.242224D+01  0.415684D+00
      3   0.350686D+01 -0.184505D+01  0.305459D+00  0.415684D+00 -0.591005D-01
               211           212           213           214           215 
      1   0.112643D+01  0.197783D+01 -0.260408D+00  0.202352D+00 -0.322884D+00
      2   0.197783D+01 -0.189677D+01  0.312361D+00 -0.322884D+00  0.319508D+00
      3  -0.260408D+00  0.312361D+00  0.104259D+01  0.470256D+00 -0.623812D+00
               216           217           218           219           220 
      1   0.470256D+00 -0.313385D+00  0.227998D+01 -0.397542D+00  0.211838D+01
      2  -0.623812D+00  0.227998D+01  0.243047D+01 -0.659335D+00 -0.182461D+01
      3  -0.436532D-01 -0.397542D+00 -0.659335D+00  0.142734D+01 -0.565464D+00
               221           222           223           224           225 
      1  -0.182461D+01 -0.565464D+00 -0.620497D+00 -0.447472D+00 -0.164564D+01
      2   0.312095D+00 -0.177078D+01 -0.447472D+00 -0.169472D+01 -0.348904D+01
      3  -0.177078D+01 -0.543038D+01 -0.164564D+01 -0.348904D+01  0.257802D+01
               226           227           228           229           230 
      1  -0.120745D+01 -0.179975D+01  0.410121D+00 -0.585203D+00 -0.196528D+01
      2  -0.179975D+01 -0.329775D+01  0.660313D+00 -0.196528D+01 -0.882630D+01
      3   0.410121D+00  0.660313D+00 -0.443809D+00  0.387311D+00  0.157776D+01
               231           232           233           234           235 
      1   0.387311D+00  0.229686D+00  0.494001D+00  0.861749D-01  0.492706D+01
      2   0.157776D+01  0.494001D+00  0.172497D+01 -0.598255D+00 -0.397512D+01
      3  -0.110195D+01  0.861749D-01 -0.598255D+00  0.317172D+00  0.408793D+00
               236           237           238           239           240 
      1  -0.397512D+01  0.408793D+00 -0.462763D+01  0.547619D+01 -0.804124D+00
      2   0.410369D+01 -0.418439D+00  0.547619D+01 -0.831732D+01  0.957264D+00
      3  -0.418439D+00  0.520762D+00 -0.804124D+00  0.957264D+00 -0.944858D+00
               241           242           243           244           245 
      1   0.482433D+00 -0.779634D+00 -0.159904D+00  0.304320D+01  0.252499D+01
      2  -0.779634D+00  0.111825D+01 -0.417649D+00  0.252499D+01  0.144914D+01
      3  -0.159904D+00 -0.417649D+00  0.278310D+00 -0.645540D+00 -0.391794D+00
               246           247           248           249           250 
      1  -0.645540D+00  0.394708D+01  0.313214D+01 -0.777617D+00 -0.913665D+00
      2  -0.391794D+00  0.313214D+01  0.517643D+01 -0.105564D+01 -0.735392D+00
      3   0.298619D+00 -0.777617D+00 -0.105564D+01  0.767682D+00  0.223346D+00
               251           252           253           254           255 
      1  -0.735392D+00  0.223346D+00 -0.126192D+01 -0.449547D+00 -0.448584D+00
      2  -0.106497D+01  0.157888D+00 -0.449547D+00 -0.228495D+00  0.115876D+00
      3   0.157888D+00 -0.133024D+00 -0.448584D+00  0.115876D+00 -0.109554D+01
               256           257           258           259           260 
      1   0.778421D+00  0.145489D+01 -0.102642D+01 -0.392521D+01 -0.143244D+01
      2   0.145489D+01  0.138847D+01 -0.152884D+01 -0.143244D+01 -0.136563D+01
      3  -0.102642D+01 -0.152884D+01  0.248057D+01  0.306206D+01  0.221877D+01
               261           262           263           264           265 
      1   0.306206D+01  0.158182D+02 -0.112057D+01 -0.692064D+00 -0.373129D+01
      2   0.221877D+01 -0.112057D+01  0.954658D+00  0.115550D+00  0.146202D+01
      3  -0.653851D+01 -0.692064D+00  0.115550D+00  0.110588D+01  0.265081D+00
               266           267           268           269           270 
      1   0.146202D+01  0.265081D+00 -0.214589D+00  0.112164D+00  0.155724D+01
      2  -0.795465D+00  0.659719D-01  0.112164D+00  0.151139D+00  0.153125D+00
      3   0.659719D-01 -0.139936D+00  0.155724D+01  0.153125D+00 -0.337295D+00
               271           272           273           274           275 
      1  -0.501741D+00  0.420913D-01  0.890022D+00  0.263167D+01  0.284065D+01
      2   0.420913D-01 -0.111146D-01  0.143757D-01  0.284065D+01  0.349007D+01
      3   0.890022D+00  0.143757D-01 -0.576227D+00  0.134701D+01  0.224933D+01
               276           277           278           279 
      1   0.134701D+01  0.417878D+01  0.199553D+01  0.200837D+01
      2   0.224933D+01  0.199553D+01  0.230964D+01  0.238441D+01
      3   0.250674D+01  0.200837D+01  0.238441D+01  0.328290D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1   0.324788D+01  0.220748D+01 -0.315645D+00  0.355882D+01 -0.191797D+01
      2   0.783895D+01  0.400119D+01 -0.206069D+00  0.789733D+01 -0.513759D+01
      3   0.454067D+01  0.241492D+02 -0.528657D+01  0.277297D+02 -0.243322D+02
                 6             7             8             9            10 
      1   0.160105D+00 -0.582550D+01  0.835575D+01 -0.148611D+01 -0.969628D+00
      2   0.202927D+01 -0.207840D+02  0.411268D+01 -0.879573D-02 -0.654737D+01
      3   0.280523D+01 -0.118927D+01  0.147914D+01  0.275340D+00  0.272855D+02
                11            12            13            14            15 
      1   0.296573D+01 -0.946220D+00 -0.788745D+00  0.792953D+00  0.340025D+00
      2   0.445064D+01 -0.514856D+01  0.127460D+01 -0.421649D+01  0.750296D+00
      3   0.175638D+02 -0.402915D+01  0.563656D+02 -0.331069D+02  0.289978D+01
                16            17            18            19            20 
      1  -0.626937D+01  0.872238D+01 -0.132209D+01 -0.380211D+01 -0.829905D+00
      2  -0.203290D+02  0.368251D+01  0.992333D+00 -0.943279D+01 -0.343792D+01
      3  -0.777362D+01  0.388190D+01  0.377175D+00 -0.600070D+00 -0.265284D+02
                21            22            23            24            25 
      1   0.332011D+00 -0.465325D+00  0.281113D+00 -0.133049D+01 -0.865010D+01
      2   0.399951D+00  0.243482D+01  0.210637D+01  0.113771D+01 -0.189097D+02
      3   0.555531D+01 -0.595987D+01  0.575306D+01 -0.223326D+01  0.663793D+01
                26            27            28            29            30 
      1   0.439856D+01 -0.112677D+01  0.670225D+00  0.172775D+01  0.484828D+00
      2   0.871846D+01 -0.756454D+00  0.763499D+01  0.206223D+01  0.950220D+00
      3  -0.209383D+01 -0.800271D+00 -0.263477D+02  0.132156D+02 -0.170540D+01
                31            32            33            34            35 
      1   0.576945D+01  0.366963D+01  0.113537D+01  0.382908D+01  0.135993D+02
      2   0.278845D+00  0.207097D+00  0.437171D+00 -0.137927D+02  0.809190D+00
      3   0.314019D+02 -0.256614D+01 -0.119509D+01 -0.191764D+01 -0.269031D+01
                36            37            38            39            40 
      1  -0.224110D+01  0.576385D-02 -0.362074D+00  0.444594D+01  0.133395D+01
      2   0.775780D+00 -0.383841D+01 -0.937414D+00  0.178159D+00 -0.346284D+01
      3  -0.236253D+01 -0.780385D+01 -0.250989D+01 -0.668237D-01  0.131585D+02
                41            42            43            44            45 
      1  -0.104066D+01 -0.278385D+01  0.174883D+02  0.119432D+01 -0.211096D+00
      2  -0.338676D+01 -0.174103D+01 -0.102537D+02 -0.668754D+01  0.252939D+01
      3  -0.720986D+01  0.256992D+00 -0.388920D+01  0.164123D+01 -0.598427D+01
                46            47            48            49            50 
      1  -0.802907D+00 -0.181958D+01 -0.472740D+01 -0.276287D+01  0.677307D+00
      2   0.412037D+01 -0.336796D+01  0.234414D+01 -0.590518D+01  0.545797D+01
      3   0.222025D+02 -0.227028D+02  0.346671D+01 -0.985268D+01  0.245566D+02
                51            52            53            54            55 
      1  -0.212000D+01 -0.117468D+02 -0.250001D+01  0.309677D+01  0.168393D+01
      2  -0.909898D+00 -0.155737D+02  0.151003D+01  0.121984D+01  0.551334D+01
      3  -0.292438D+01  0.389775D+01 -0.246725D+01  0.534602D+01  0.325245D+02
                56            57            58            59            60 
      1  -0.367158D+01 -0.420360D+01 -0.243552D+01  0.135116D+01 -0.162170D+01
      2  -0.389055D+01 -0.297273D+01 -0.560701D+01  0.397943D+01 -0.189960D+01
      3  -0.125653D+02  0.226124D+01 -0.730087D+01  0.256353D+02 -0.163802D+01
                61            62            63            64            65 
      1  -0.117602D+02 -0.230045D+01  0.210586D+01 -0.239778D+00 -0.507336D+00
      2  -0.212855D+02 -0.202466D+01  0.516405D+01  0.111177D+01  0.796617D+00
      3   0.502689D+01 -0.109536D+01  0.128750D+02  0.184125D+01 -0.281008D-01
                66            67            68            69            70 
      1  -0.167142D+01 -0.725050D+00 -0.149685D+01 -0.274203D+01 -0.595216D+00
      2   0.495652D+00  0.112832D+01 -0.296554D-01  0.182176D+01 -0.241095D+01
      3   0.242706D-02  0.322691D+01 -0.513378D+01  0.846496D+00 -0.197998D+00
                71            72            73            74            75 
      1   0.220499D+01  0.386745D+00 -0.298794D+00  0.195733D+00  0.210134D+01
      2  -0.897079D+00  0.120008D-01 -0.745422D+00 -0.154224D+00  0.131138D+01
      3   0.857029D+00  0.580471D+00 -0.834830D+01  0.158302D+01  0.310796D-02
                76            77            78            79            80 
      1  -0.112750D+01  0.835713D+00 -0.394614D+01 -0.295261D+01  0.156059D+01
      2  -0.431929D+00  0.702954D+00 -0.229271D+01 -0.157450D+01 -0.150045D+00
      3   0.396229D+01  0.148279D+01  0.386249D+00  0.376362D+00 -0.416232D+00
                81            82            83            84            85 
      1   0.488854D+00  0.812755D+00  0.553464D+00 -0.200910D+01  0.667323D+00
      2   0.526880D+00  0.989613D+00  0.496840D+00  0.100531D+01  0.674731D+00
      3   0.128249D+01  0.698359D+01  0.334363D+01 -0.122283D+01  0.527333D+01
                86            87            88            89            90 
      1   0.140386D+01 -0.449492D+01  0.102918D+01  0.187441D+01  0.453597D+00
      2   0.739353D+00  0.138841D+01 -0.924568D+00  0.636377D+00 -0.659371D+00
      3   0.395665D+01 -0.120285D+01 -0.110806D+01 -0.142600D+01 -0.518133D+00
                91            92            93            94            95 
      1   0.290042D+01  0.939834D+00 -0.172975D+01  0.562285D+01 -0.752320D+00
      2  -0.785084D+01 -0.209347D+01 -0.655099D+01 -0.287073D+01 -0.866688D+01
      3   0.152278D+02 -0.161597D+01  0.283139D+01  0.227101D+02 -0.197563D+02
                96            97            98            99           100 
      1  -0.230720D+01 -0.284630D+01  0.537827D+01  0.128124D+01  0.182811D+01
      2  -0.262918D+01 -0.360738D+02  0.199519D+00  0.362192D+01 -0.120894D+02
      3   0.798999D+01  0.124507D+01  0.113250D+02  0.842158D+01  0.167657D+01
               101           102           103           104           105 
      1  -0.626010D+01  0.409567D+00 -0.258983D+01  0.422165D+01 -0.114725D+02
      2   0.205324D+01  0.174935D+02 -0.523100D+00  0.188613D+02  0.648278D+01
      3  -0.140637D+02 -0.142860D+01 -0.926069D+01  0.864516D+01 -0.157711D+02
               106           107           108           109           110 
      1   0.317568D+01 -0.579317D+01 -0.529170D+01 -0.534390D+01  0.941956D+00
      2   0.176777D+02  0.271016D+01 -0.424633D+01  0.136437D+02  0.446131D+01
      3   0.572738D+01 -0.148327D+02 -0.761096D+01 -0.565995D+01  0.106136D+02
               111           112           113           114           115 
      1   0.979636D+01 -0.115996D+02 -0.666496D+01 -0.833267D+01  0.946590D+01
      2   0.245816D+01  0.592174D+01  0.405440D+01 -0.101025D+02  0.862312D+01
      3  -0.668877D+01  0.909478D+01  0.177770D+02 -0.193663D+01 -0.183303D+02
               116           117           118           119           120 
      1   0.920801D-02  0.585699D+01  0.124594D+01 -0.109727D+01  0.101750D+01
      2  -0.207141D+01  0.207720D+01  0.278834D+01 -0.977676D+00  0.501008D+01
      3  -0.626023D+01 -0.516262D+01  0.929779D+01 -0.638137D+01 -0.239947D+00
               121           122           123           124           125 
      1  -0.132263D+01  0.248996D+01 -0.300698D+01  0.101432D+01 -0.429545D+00
      2  -0.175308D+01  0.464154D+01 -0.507910D+01  0.289686D+01 -0.356284D+01
      3  -0.100577D+01  0.212011D+02 -0.371471D+01 -0.105522D+01 -0.530093D+01
               126           127           128           129           130 
      1   0.547322D+00 -0.264770D+01  0.268885D+01 -0.477696D+00  0.973620D+00
      2   0.175405D+01 -0.299771D+01  0.291898D+01 -0.450768D+01  0.267062D+01
      3   0.234141D+01 -0.500550D+01  0.387408D+01 -0.115432D+01  0.333582D+01
               131           132           133           134           135 
      1  -0.108168D+02  0.346949D+01  0.120691D+00  0.503231D+01 -0.272804D+01
      2  -0.100760D+02  0.906606D+01 -0.188879D+01  0.450103D+01 -0.724636D+01
      3  -0.169692D+02  0.919688D+01  0.620164D+00  0.580737D+01 -0.504031D+01
               136           137           138           139           140 
      1  -0.161588D+01 -0.254850D+01  0.845722D+00 -0.241296D+01 -0.780152D+00
      2   0.112822D+02  0.677978D-01  0.739046D+01  0.182242D+00 -0.776593D+00
      3  -0.546933D+01 -0.579942D+01  0.722856D+00 -0.379797D+01 -0.739500D+00
               141           142           143           144           145 
      1   0.334961D+00 -0.116984D+00  0.131186D+01  0.605367D-01  0.184921D+01
      2  -0.174152D+00  0.158872D+01  0.390180D+00  0.985355D+00 -0.490096D+01
      3   0.243387D+01 -0.864750D+00  0.275580D+01 -0.479373D+00  0.348928D+01
               146           147           148           149           150 
      1   0.302572D+01  0.213370D+00  0.182893D+01  0.584154D+01  0.240330D+01
      2  -0.470479D+01 -0.838675D+01 -0.278549D+01 -0.119376D+02 -0.133439D+02
      3   0.445854D+01  0.318006D+01  0.358175D+01  0.110359D+02  0.101626D+02
               151           152           153           154           155 
      1  -0.226179D+00  0.498762D+01  0.250150D+01  0.461936D+01  0.915435D+00
      2  -0.423684D+01 -0.956245D+01 -0.170969D+02 -0.108996D+02 -0.108343D+01
      3  -0.115142D+00  0.765273D+01  0.884794D+01 -0.888375D+01 -0.220699D+02
               156           157           158           159           160 
      1  -0.592978D+01  0.790222D+01  0.438759D+01 -0.338541D+01 -0.334393D+01
      2   0.206416D+02 -0.343114D+00 -0.450754D+01  0.116852D+02  0.529964D+01
      3  -0.510708D+00 -0.185937D+02 -0.237118D+02  0.385922D+00  0.399878D+01
               161           162           163           164           165 
      1   0.146930D+01  0.137844D+01  0.644845D+01  0.302143D+01 -0.302507D+01
      2   0.336943D+01 -0.827488D+01 -0.141482D+02 -0.523421D+01  0.309022D+01
      3   0.413435D+01 -0.266190D+01 -0.937321D+01 -0.383157D+01  0.584667D+00
               166           167           168           169           170 
      1   0.863674D+01  0.451614D+01  0.221969D+01 -0.138539D+01  0.716781D+01
      2  -0.961427D+01  0.482297D+01  0.857532D+01 -0.242093D+01  0.352831D+01
      3  -0.102139D+01 -0.450502D+01 -0.912183D+01  0.654492D+01 -0.216695D+01
               171           172           173           174           175 
      1  -0.267004D+01 -0.783014D+01 -0.355679D+01  0.473961D+00 -0.967714D+01
      2   0.235286D+02  0.228753D+02  0.396750D+01 -0.769735D+01  0.919903D+01
      3  -0.318753D+01  0.289189D+01  0.241842D+01  0.230709D+01  0.895677D+01
               176           177           178           179           180 
      1  -0.301545D+01 -0.189971D+01  0.627136D-01 -0.171170D+00 -0.723902D+00
      2   0.378703D+01 -0.436520D+01 -0.296778D+01 -0.102867D+01  0.576047D+01
      3   0.871379D+00  0.634396D+00  0.197768D+01  0.773194D+00  0.746193D+00
               181           182           183           184           185 
      1  -0.718608D+00  0.213441D+01  0.439892D+01  0.269025D+01 -0.107800D+01
      2  -0.698189D+01 -0.191622D+01  0.597549D+01 -0.113177D+01 -0.789219D+01
      3  -0.308594D+02 -0.129351D+02  0.297965D+01 -0.121346D+02 -0.277787D+02
               186           187           188           189           190 
      1  -0.234673D+01  0.159696D+02  0.402089D+01 -0.254791D+01 -0.100229D+01
      2  -0.860684D+00 -0.229701D+01 -0.109023D+02  0.106062D+01 -0.402444D+01
      3   0.616732D+01  0.354237D+01  0.769178D+01 -0.297253D+01  0.110910D+02
               191           192           193           194           195 
      1   0.331526D+01 -0.443840D+00  0.338284D+01  0.216623D+01  0.275359D+01
      2   0.412773D+01 -0.216710D+01  0.137435D+02  0.156057D+01 -0.272714D+01
      3   0.213470D+02 -0.404262D+01  0.532286D+02  0.179164D+02 -0.571169D+01
               196           197           198           199           200 
      1  -0.421429D+01  0.147542D+02 -0.312920D+01  0.235704D+00 -0.205708D+01
      2  -0.166010D+01 -0.503437D+01  0.115093D+01  0.270575D+01 -0.208353D+01
      3  -0.101176D+02 -0.402903D+01  0.603022D+01 -0.209477D+02 -0.121460D+02
               201           202           203           204           205 
      1   0.270430D+00 -0.203572D+01  0.134542D+01 -0.305927D+01 -0.393481D+01
      2   0.419815D+01 -0.862424D+01  0.436223D+01  0.344052D+01 -0.172477D+02
      3   0.237454D+01 -0.400291D+01  0.207708D+00 -0.165208D+01  0.541787D+01
               206           207           208           209           210 
      1   0.393651D+01  0.252242D+00  0.105322D+01 -0.310711D+01  0.725256D+00
      2   0.153934D+02 -0.432183D+01  0.312514D+01 -0.528582D+01  0.130437D+02
      3  -0.371547D+01 -0.673574D+01  0.940035D+01 -0.407853D+02  0.479557D+01
               211           212           213           214           215 
      1   0.258188D+00 -0.938001D+00 -0.575334D+01  0.252402D+01 -0.146989D+01
      2  -0.121434D+01  0.231120D+01  0.637752D+01 -0.562412D+01 -0.380340D+01
      3  -0.241385D+01  0.116441D+02 -0.258225D+01  0.746269D+00  0.179434D+01
               216           217           218           219           220 
      1   0.117885D+01 -0.142808D+01  0.485024D+00 -0.120025D+01  0.304897D+01
      2  -0.744576D+00 -0.683571D+01 -0.126325D+01  0.786763D+01 -0.272975D+01
      3   0.159321D+01 -0.364052D+02 -0.227522D+01  0.376624D+01  0.109316D+02
               221           222           223           224           225 
      1   0.374055D+01  0.545884D+01  0.124384D+02  0.696887D+01 -0.171919D+01
      2  -0.677680D+01 -0.328754D+02 -0.871304D+01 -0.212475D+02  0.160515D+02
      3   0.200707D+02  0.707158D+01  0.363076D+01  0.568202D+01  0.271401D+02
               226           227           228           229           230 
      1   0.215515D+00 -0.300446D+00 -0.193534D+01  0.937467D-02 -0.813242D+00
      2   0.191483D+01  0.185832D+01 -0.532586D-01  0.138417D+01  0.372435D+01
      3   0.904330D+01  0.804446D+01 -0.206996D+01  0.666935D+01  0.184524D+02
               231           232           233           234           235 
      1  -0.406887D+01  0.124855D+01  0.199634D+01  0.362466D+00 -0.787573D+00
      2  -0.593131D+00 -0.149273D+00 -0.117367D+01  0.139106D-01 -0.864907D+00
      3  -0.373612D+01 -0.207187D+01 -0.394748D+01  0.285994D+00 -0.116923D+00
               236           237           238           239           240 
      1   0.839744D+00  0.212864D+01 -0.163930D+00 -0.903045D+00 -0.363641D+01
      2   0.306589D-01  0.247763D+01 -0.100291D+01  0.116601D+01 -0.386489D+01
      3  -0.566576D+01  0.573204D+00 -0.610035D+01  0.165886D+02 -0.136741D+01
               241           242           243           244           245 
      1  -0.273647D+01  0.114574D+01  0.577831D+00  0.294003D+00 -0.520166D-01
      2  -0.208290D+01 -0.133261D+01  0.126371D+01 -0.653997D+00 -0.842498D+00
      3   0.188037D+01 -0.214082D+01  0.197486D+01 -0.438025D+00 -0.266026D+01
               246           247           248           249           250 
      1  -0.109551D+01  0.203197D+00 -0.281533D+00 -0.264435D+01 -0.366393D+00
      2   0.103079D+01 -0.999770D+00 -0.279156D+01  0.281582D+01 -0.112581D+01
      3   0.447560D+00 -0.117866D+01 -0.132773D+02  0.234483D+01  0.558668D+00
               251           252           253           254           255 
      1   0.132621D+01  0.365970D+00 -0.441382D+00  0.618726D+00  0.148647D+01
      2  -0.786372D+00 -0.123393D+00 -0.548599D+01  0.958531D+00 -0.566152D+01
      3   0.280489D+01  0.496603D-01  0.125296D+01  0.327319D+01 -0.257405D+01
               256           257           258           259           260 
      1  -0.219363D+00 -0.199302D+00 -0.207247D+01 -0.268875D+01  0.137807D+01
      2  -0.443707D+01 -0.836653D+01  0.141439D+02  0.102512D+02  0.129266D+02
      3  -0.539821D+01 -0.127205D+02  0.103629D+02  0.564005D+01  0.111823D+02
               261           262           263           264           265 
      1   0.529495D+01  0.707770D+00 -0.563238D+00 -0.344557D+00 -0.585123D+00
      2  -0.357965D+02  0.117562D+01  0.626102D-01  0.863998D+01  0.434496D+00
      3  -0.175692D+02  0.155777D+02 -0.994480D+01 -0.907992D+00 -0.834041D+01
               266           267           268           269           270 
      1   0.127090D+00 -0.762783D+00 -0.133063D+01  0.944712D-01  0.177175D+00
      2   0.837531D+00 -0.104527D+01  0.727136D+01  0.888893D+00 -0.164067D+01
      3   0.563766D+01 -0.495088D+00 -0.926197D+00 -0.777305D+00 -0.997153D+00
               271           272           273           274           275 
      1   0.110532D+00  0.156476D+00  0.924868D+00 -0.183803D+01 -0.289771D+01
      2   0.644028D+01  0.706897D+00 -0.247177D+01  0.621215D+01  0.112399D+02
      3  -0.177032D+01  0.192028D+01  0.330471D+00 -0.116757D+02 -0.259228D+02
               276           277           278           279 
      1  -0.466598D+01 -0.367386D+01 -0.151974D+01 -0.542457D+01
      2   0.143521D+02  0.712835D+01  0.131852D+02  0.175638D+02
      3  -0.137989D+02 -0.791244D+01 -0.161031D+02 -0.160852D+02
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.761695D+02  0.367448D+02 -0.279563D+01 -0.706559D+02  0.447208D+01
      2   0.369437D+02 -0.234615D+02  0.211127D+01  0.365056D+02  0.467873D+01
      3   0.392259D+02 -0.132833D+02  0.684366D+00  0.341503D+02 -0.915081D+01
      4   0.180146D+02  0.922352D+01 -0.227167D+01  0.114228D+02 -0.196918D+02
      5  -0.583781D+01 -0.278261D+01  0.877648D+00 -0.547338D+01  0.629938D+01
      6   0.400407D+01  0.252172D+00  0.112907D+01  0.386033D+01 -0.504972D+01
                 6             7             8             9            10 
      1   0.208621D+01  0.179069D+02 -0.493123D+01 -0.972590D+01  0.115911D+03
      2  -0.376449D+01 -0.774142D+01  0.156553D+01 -0.121566D+01 -0.539917D+02
      3   0.167828D+01 -0.101654D+02  0.336570D+01  0.109416D+02 -0.619188D+02
      4   0.343873D+01 -0.315453D+01  0.303374D+01 -0.442230D+00  0.421274D+01
      5   0.252616D+01  0.899068D+00 -0.585772D+00  0.174399D+00  0.277182D+00
      6   0.375216D+00  0.192814D+01  0.341652D+01  0.145403D+01 -0.776396D+01
                11            12            13            14            15 
      1  -0.677980D+01 -0.736312D+01  0.532044D+02 -0.283855D+02  0.130973D+01
      2   0.136746D+01  0.320592D+01 -0.176510D+02  0.197167D+02 -0.354835D+01
      3   0.541234D+01  0.415720D+01 -0.355534D+02  0.866885D+01  0.223862D+01
      4   0.133919D+02 -0.458376D+01 -0.259643D+02  0.172513D+02 -0.113462D+01
      5  -0.657809D+01 -0.849834D+01  0.894659D+01 -0.277787D+01 -0.108851D-01
      6   0.332464D+01  0.864820D+00 -0.423989D+01 -0.272685D+00 -0.679590D+00
                16            17            18            19            20 
      1  -0.176533D+02  0.503766D+01 -0.429672D+01  0.446168D+02 -0.430808D+02
      2   0.721890D+01 -0.356271D+01 -0.327041D+01 -0.199562D+02  0.306307D+02
      3   0.104344D+02 -0.147495D+01  0.756713D+01 -0.246606D+02  0.124500D+02
      4   0.572631D+01 -0.297563D+01  0.384055D+01 -0.224533D+02 -0.114369D+02
      5   0.155820D+01  0.309208D+01  0.102165D+01  0.846036D+01  0.339654D+01
      6   0.481217D+01  0.313094D+01  0.186445D+01 -0.401113D+01  0.392886D+00
                21            22            23            24            25 
      1   0.448116D+01  0.353808D+01  0.336664D+02 -0.490684D+01 -0.468842D+01
      2  -0.348830D+01 -0.206275D+02 -0.323300D+02  0.618625D+01  0.758179D+01
      3  -0.992862D+00  0.170894D+02 -0.133632D+01 -0.127941D+01 -0.289338D+01
      4   0.239640D+01  0.161559D+02 -0.271539D+01  0.343283D+01 -0.201362D+01
      5  -0.377996D+01 -0.624439D+01  0.372218D+01  0.796356D+01  0.454760D+01
      6   0.751684D+00  0.106656D+02  0.536341D+01  0.160054D+01  0.295889D+01
                26            27            28            29            30 
      1  -0.205091D+01 -0.778017D+01  0.102492D+02  0.262019D+00  0.382472D+01
      2   0.572071D+01 -0.655842D+01 -0.275747D+02 -0.283556D+01 -0.144802D+01
      3  -0.366980D+01  0.143386D+02  0.173254D+02  0.257355D+01 -0.237670D+01
      4   0.524366D+01  0.430722D+01  0.155082D+01  0.141538D+02  0.894681D+00
      5   0.922595D+01 -0.238756D+01 -0.126201D+02  0.259546D+01  0.106905D+02
      6   0.430142D+01 -0.533562D+00  0.126164D+02 -0.175129D+01 -0.246288D+01
                31            32            33            34            35 
      1   0.213674D+02 -0.626141D+02  0.720789D+01 -0.466828D+01  0.101078D+02
      2  -0.773560D+01  0.577728D+02 -0.112358D+02  0.132958D+00 -0.109186D+02
      3  -0.136319D+02  0.484125D+01  0.402794D+01  0.453532D+01  0.810835D+00
      4  -0.372146D+02 -0.109130D+02  0.417171D+01  0.147125D+02  0.319597D+01
      5   0.110259D+02  0.471121D+01 -0.138777D+01  0.338644D+02 -0.610525D+01
      6  -0.190978D+01 -0.515624D+01 -0.186615D+01 -0.704732D+01  0.595440D+01
                36            37            38            39            40 
      1  -0.254009D+00 -0.529482D+01  0.660345D+02 -0.128594D+02 -0.210686D+02
      2  -0.868193D+01  0.370283D+00 -0.507651D+02  0.779234D+01  0.243543D+02
      3   0.893594D+01  0.492454D+01 -0.152694D+02  0.506709D+01 -0.328568D+01
      4  -0.529040D+00  0.201955D+02 -0.147662D+02 -0.137308D+00  0.163157D+02
      5  -0.339001D+00 -0.330363D+01 -0.335123D+01  0.129827D+01  0.366784D+01
      6   0.546800D+01 -0.394418D+01  0.375601D+01 -0.871762D+01 -0.113317D+02
                41            42            43            44            45 
      1   0.235958D+02 -0.762663D+01  0.658091D+01 -0.135201D+02 -0.132519D+02
      2  -0.278755D+02  0.727257D+01 -0.105174D+02  0.150870D+02  0.378734D+01
      3   0.427975D+01  0.354063D+00  0.393651D+01 -0.156695D+01  0.946453D+01
      4   0.169294D+02 -0.757257D+01  0.603057D+00 -0.551070D+01 -0.714407D+01
      5  -0.878080D+01 -0.728411D+01  0.191320D+02 -0.834244D+01  0.421730D+01
      6   0.861539D+01  0.513949D+01 -0.190684D+02  0.169394D+02  0.291467D+00
                46            47            48            49            50 
      1   0.157437D+01 -0.513721D+02  0.768191D+01  0.297332D+02  0.379509D+01
      2  -0.247346D+01  0.402466D+02 -0.328871D+01 -0.257433D+02 -0.996708D+01
      3   0.899093D+00  0.111255D+02 -0.439320D+01 -0.398986D+01  0.617199D+01
      4  -0.152486D+02 -0.730325D+01  0.383634D+01  0.943998D+01 -0.120157D+02
      5   0.487858D+01  0.574937D+01  0.593887D+00 -0.234918D+01  0.254114D+01
      6   0.406978D+01  0.775224D+00  0.791666D+01  0.342148D+01  0.102106D+02
                51            52            53            54            55 
      1  -0.693757D+01 -0.540364D+01 -0.167147D+01 -0.214252D+02 -0.213836D+02
      2   0.772559D+01  0.689941D+01  0.871913D+01  0.959421D+01  0.796177D+01
      3  -0.788015D+00 -0.149577D+01 -0.704766D+01  0.118310D+02  0.134218D+02
      4   0.370943D+01  0.175322D+01  0.665262D+01  0.673655D+01  0.562889D+01
      5   0.840646D+00  0.461340D+01  0.308333D+01 -0.453944D+00 -0.265740D+01
      6   0.384868D+01  0.454078D+01  0.211353D+02 -0.528179D+01  0.310989D+01
                56            57            58            59            60 
      1  -0.357182D+02  0.586298D+01  0.104167D+02  0.152916D+02 -0.859487D+01
      2   0.313778D+02 -0.207590D+01 -0.119654D+02 -0.160408D+02  0.809926D+01
      3   0.434036D+01 -0.378707D+01  0.154869D+01  0.749265D+00  0.495612D+00
      4  -0.475060D+02  0.753899D+01  0.114529D+02 -0.653256D+01 -0.235016D+00
      5   0.107979D+02 -0.805838D+01 -0.246710D+01 -0.157321D+01 -0.878590D+00
      6  -0.265075D+01  0.828250D+01  0.375532D+01  0.941301D+01  0.269366D+01
                61            62            63            64            65 
      1  -0.198139D+01 -0.558901D+01 -0.269724D+02  0.327679D+01 -0.112797D+01
      2   0.532007D+01  0.116562D+02  0.984169D+01 -0.437249D+00  0.235691D+01
      3  -0.333868D+01 -0.606723D+01  0.171307D+02 -0.283954D+01 -0.122894D+01
      4  -0.278436D+01  0.354778D+01 -0.521199D+01  0.975129D+01  0.101137D+02
      5  -0.236170D+01 -0.987270D+01  0.621576D+01 -0.292939D+01 -0.222473D+01
      6   0.578919D+01  0.190224D+02 -0.635087D+01 -0.185153D+01 -0.152157D+01
                66            67            68            69            70 
      1   0.267408D+00 -0.407922D+01 -0.144994D+02  0.333587D+01  0.797521D-02
      2   0.241181D+00  0.628054D+01  0.172398D+02 -0.161999D+01  0.125014D+00
      3  -0.508589D+00 -0.220132D+01 -0.274043D+01 -0.171588D+01 -0.132989D+00
      4  -0.171604D+01  0.137352D+02  0.182756D+02 -0.333458D+01 -0.293269D+01
      5   0.282709D+01 -0.351710D+01 -0.351343D+01  0.351331D+01  0.150215D+01
      6   0.147153D+01 -0.318426D+01 -0.609224D+01  0.492043D+01  0.206919D+01
                71            72            73            74            75 
      1   0.200814D+01 -0.268090D+01 -0.108783D+01  0.707882D+01 -0.875969D+00
      2  -0.187502D+01  0.244306D+01  0.105613D+02 -0.162137D+02  0.147586D+01
      3  -0.133120D+00  0.237841D+00 -0.947349D+01  0.913491D+01 -0.599894D+00
      4  -0.352448D+01  0.228949D+01 -0.224244D+02  0.224301D+02 -0.238757D+01
      5   0.714619D+00 -0.135990D+01  0.188502D+01 -0.244525D+01  0.290446D+01
      6   0.292810D+01 -0.201952D+01 -0.113303D+01  0.154833D+01 -0.267977D+01
                76            77            78            79            80 
      1   0.124497D+02 -0.298379D+02  0.354691D+01 -0.238019D+01  0.441103D+01
      2  -0.236834D+02  0.479342D+02 -0.443456D+01  0.422500D+01 -0.636569D+01
      3   0.112337D+02 -0.180963D+02  0.887652D+00 -0.184481D+01  0.195466D+01
      4   0.244889D+02 -0.338789D+02  0.375037D+01 -0.326238D+01  0.415276D+01
      5  -0.327756D+01  0.422805D+01 -0.346602D+01  0.268938D+00 -0.206282D+01
      6   0.374464D+01 -0.533201D+01  0.655191D+01  0.116069D+01  0.319428D+01
                81            82            83            84            85 
      1  -0.158502D+01 -0.622240D+01 -0.105774D+02  0.243748D+01 -0.968523D+01
      2   0.270800D+01  0.102504D+02  0.171383D+02 -0.275085D+01  0.139132D+02
      3  -0.112298D+01 -0.402798D+01 -0.656092D+01  0.313366D+00 -0.422793D+01
      4  -0.274499D+01  0.115979D+02  0.194722D+02 -0.340579D+01  0.121972D+02
      5   0.108930D+01 -0.133901D+01 -0.196657D+01  0.288119D+01 -0.138818D+01
      6  -0.190229D+01 -0.255164D+01 -0.394116D+01  0.334506D+01 -0.289029D+01
                86            87            88            89            90 
      1  -0.415968D+02  0.788021D+01  0.187442D+01  0.841010D+01 -0.262629D+01
      2   0.584488D+02 -0.884786D+01 -0.283108D+01 -0.104422D+02  0.307620D+01
      3  -0.168520D+02  0.967649D+00  0.956660D+00  0.203209D+01 -0.449912D+00
      4   0.274772D+02 -0.451570D+01 -0.320514D+01 -0.508738D+01  0.323012D+01
      5  -0.199190D+01  0.215149D+01  0.816542D+00  0.285957D+01 -0.143066D+01
      6  -0.109819D+02  0.852175D+01  0.981455D+00  0.521330D+01 -0.289279D+01
                91            92            93            94            95 
      1  -0.770304D+01  0.181260D+01 -0.145638D+02 -0.663108D+01 -0.154224D+01
      2   0.139491D+02  0.235653D+01  0.123910D+01  0.129253D+02 -0.115331D+02
      3  -0.624607D+01 -0.416913D+01  0.133247D+02 -0.629423D+01  0.130753D+02
      4  -0.576887D+01 -0.144563D+02 -0.383742D+01 -0.165371D+02  0.379004D+02
      5  -0.971264D+00 -0.465245D+01 -0.214245D+02  0.164686D+01 -0.132652D+02
      6  -0.541305D+01  0.171070D+01  0.110590D+01 -0.430802D+01  0.335724D+01
                96            97            98            99           100 
      1  -0.216973D+01 -0.265369D+01 -0.420121D+01 -0.213734D+02 -0.789158D+02
      2   0.148271D+01 -0.126378D+02  0.907226D+01  0.204999D+02  0.448949D+02
      3   0.687019D+00  0.152915D+02 -0.487105D+01  0.873530D+00  0.340209D+02
      4  -0.152418D+02 -0.854897D+01 -0.168412D+02 -0.384074D+01  0.124506D+02
      5  -0.539559D+01 -0.647570D+02  0.205274D+01  0.160334D+02  0.427270D+02
      6   0.400201D+01  0.261153D+01 -0.624220D+00 -0.140000D+01 -0.421474D+01
               101           102           103           104           105 
      1   0.810894D+01  0.304984D+02  0.505771D+01  0.303616D+02  0.915166D+01
      2  -0.361700D+01 -0.854434D+01 -0.642214D+01 -0.509969D+01  0.268487D+00
      3  -0.449194D+01 -0.219541D+02  0.136443D+01 -0.252619D+02 -0.942015D+01
      4   0.178126D+02  0.125797D+01  0.166854D+02 -0.148225D+02  0.240592D+02
      5   0.829604D+00  0.103409D+02 -0.140922D+00  0.161360D+02  0.771183D+01
      6  -0.114222D+02 -0.325375D+01 -0.596776D+01  0.374008D+01 -0.199304D+02
               106           107           108           109           110 
      1   0.364981D+01  0.847081D+01  0.208565D+02 -0.802042D+02 -0.258553D+02
      2   0.172173D+02 -0.344585D+01 -0.224418D+02  0.306097D+02  0.468574D+01
      3  -0.208671D+02 -0.502497D+01  0.158529D+01  0.495945D+02  0.211696D+02
      4   0.228156D+01  0.196113D+02  0.442086D+01 -0.439686D+02 -0.257381D+02
      5   0.416690D+02  0.131760D+01 -0.290806D+02  0.189733D+01 -0.195185D+01
      6  -0.385454D+01 -0.141452D+02 -0.748137D+01 -0.909935D+00  0.212697D+01
               111           112           113           114           115 
      1   0.179938D+01 -0.348873D+02 -0.153733D+02  0.895102D+01  0.405900D+02
      2  -0.234875D+01  0.753834D+01  0.567122D+01 -0.638995D+00 -0.196257D+02
      3   0.549378D+00  0.273490D+02  0.970209D+01 -0.831203D+01 -0.209643D+02
      4   0.854086D+00 -0.117331D+02 -0.235159D+02  0.849233D+01  0.187510D+02
      5  -0.194186D+01 -0.324658D+01  0.606066D+01 -0.545072D+01  0.268021D+02
      6  -0.407821D+01  0.347119D+01 -0.373108D+01  0.176786D+00  0.485272D+01
               116           117           118           119           120 
      1   0.757821D+01  0.259668D+02  0.737753D+01 -0.949007D+01  0.490571D+01
      2  -0.305176D+01 -0.380283D+01  0.310565D+01  0.120395D+00 -0.125484D+01
      3  -0.452644D+01 -0.221640D+02 -0.104832D+02  0.936968D+01 -0.365087D+01
      4   0.151615D+02  0.617617D+01 -0.211418D+02  0.212021D+02 -0.920858D+00
      5   0.364565D+01  0.165478D+01  0.563427D+01 -0.519565D+00  0.100368D+02
      6  -0.112396D+01 -0.891047D+00 -0.158378D+01  0.645975D+00 -0.850685D+00
               121           122           123           124           125 
      1  -0.165727D+02 -0.207544D+01 -0.639615D+00  0.656068D+01  0.159831D+01
      2   0.260719D+01  0.199238D+02 -0.301374D+01 -0.226717D+01 -0.481981D+01
      3   0.139655D+02 -0.178483D+02  0.365335D+01 -0.429351D+01  0.322149D+01
      4   0.234055D+02 -0.497927D+02  0.772246D+01 -0.311732D+01  0.116898D+02
      5  -0.203933D+01  0.698797D+01 -0.103542D+02  0.120439D+02 -0.818495D+01
      6   0.639077D+00 -0.264174D+01  0.427061D+01 -0.262777D+01  0.631184D+01
               126           127           128           129           130 
      1   0.257512D+01  0.874627D+00  0.642854D+01 -0.887910D+01  0.986927D+01
      2  -0.642521D+00 -0.439792D+00 -0.283549D+01  0.138581D+00 -0.666227D+01
      3  -0.193260D+01 -0.434835D+00 -0.359304D+01  0.874052D+01 -0.320700D+01
      4  -0.878420D+01  0.360679D+01 -0.468457D+01  0.147952D+01  0.151834D+01
      5   0.343649D+01 -0.148420D+01 -0.100432D+01 -0.444407D+01 -0.945081D+01
      6  -0.249561D+01 -0.311279D+01  0.458733D+01 -0.168979D+01  0.177647D+00
               131           132           133           134           135 
      1  -0.159923D+02  0.873409D+01 -0.328865D+01  0.542115D+01 -0.116755D+02
      2   0.579721D+01  0.354912D+01  0.850407D+00  0.168237D+01 -0.131550D+01
      3   0.101950D+02 -0.122832D+02  0.243824D+01 -0.710352D+01  0.129910D+02
      4   0.286427D+02 -0.157944D+02 -0.103248D+01 -0.104792D+02  0.853575D+01
      5  -0.119014D+02  0.166958D+02  0.162680D+01  0.682876D+01 -0.908876D+01
      6  -0.195413D+02  0.134310D+02  0.628823D+00  0.106996D+02 -0.710311D+01
               136           137           138           139           140 
      1   0.115039D+03 -0.608314D+01 -0.208082D+02 -0.446553D+01  0.660422D+01
      2  -0.694247D+02  0.284067D+01  0.190706D+02  0.125762D+01 -0.439094D+01
      3  -0.456140D+02  0.324247D+01  0.173768D+01  0.320792D+01 -0.221328D+01
      4  -0.135413D+02  0.116927D+02  0.377129D+01  0.152614D+02 -0.133259D+01
      5  -0.662438D+02  0.427138D+01  0.302228D+02  0.258516D+01 -0.726192D+01
      6   0.569122D+01 -0.408786D+01 -0.231873D+01 -0.482757D+01  0.274605D+00
               141           142           143           144           145 
      1  -0.153433D+00 -0.770573D+01 -0.131089D+01  0.863231D+01 -0.102583D+01
      2  -0.115963D+00  0.841142D+01  0.315910D-01 -0.701612D+01 -0.926708D+00
      3   0.269396D+00 -0.705695D+00  0.127930D+01 -0.161618D+01  0.195254D+01
      4  -0.592103D+01 -0.252275D-01 -0.328035D+01 -0.111952D+01 -0.368554D+01
      5  -0.108804D+01  0.172971D+02 -0.418185D+00 -0.746299D+01 -0.320897D+01
      6   0.437940D+01 -0.668246D+00  0.257823D+01  0.111259D+01  0.451280D+01
               146           147           148           149           150 
      1  -0.104458D+02 -0.161082D+02 -0.847812D+01 -0.198102D+02 -0.174003D+02
      2   0.380281D+01  0.162263D+01  0.554564D+01  0.808410D+01  0.174938D+00
      3   0.664295D+01  0.144856D+02  0.293248D+01  0.117261D+02  0.172254D+02
      4  -0.492441D+01 -0.307579D+01  0.234691D+01 -0.192219D+02 -0.186609D+02
      5  -0.660246D+00 -0.622383D+01  0.741504D+01 -0.146901D+02 -0.208114D+02
      6   0.695520D+01  0.640302D+01  0.158613D+00  0.187628D+02  0.198142D+02
               151           152           153           154           155 
      1  -0.572637D+01 -0.129651D+02 -0.253688D+02  0.169567D+03  0.362776D+02
      2   0.211442D+01 -0.196878D+00 -0.332185D+01 -0.753020D+02 -0.105265D+02
      3   0.361194D+01  0.131620D+02  0.286906D+02 -0.942647D+02 -0.257511D+02
      4   0.202027D+01 -0.134958D+02 -0.147817D+02  0.624714D+02  0.441228D+02
      5   0.380383D+01 -0.128211D+02 -0.231005D+02  0.123696D+02  0.525689D+01
      6   0.443997D+00  0.151815D+02  0.181647D+02  0.252286D+00  0.917484D+00
               156           157           158           159           160 
      1  -0.467458D+01  0.499159D+02  0.341616D+02 -0.383146D+01 -0.823516D+01
      2  -0.157107D+01 -0.114689D+02 -0.247614D+01 -0.813524D+00  0.230765D+00
      3   0.624564D+01 -0.384469D+02 -0.316854D+02  0.464499D+01  0.800440D+01
      4   0.168568D+01  0.629361D+02  0.517126D+02 -0.460511D+01 -0.612332D+01
      5   0.321530D+02  0.237532D+01  0.221009D+00  0.152565D+02  0.295899D+02
      6   0.564519D+01  0.384537D+01  0.339453D+01  0.662295D+01  0.664347D+01
               161           162           163           164           165 
      1  -0.383647D+01  0.168254D+02  0.499383D+02  0.147988D+02  0.108499D+02
      2  -0.534236D+00 -0.983165D+01 -0.324523D+02 -0.570569D+01 -0.917502D+01
      3   0.437071D+01 -0.699374D+01 -0.174860D+02 -0.909312D+01 -0.167489D+01
      4  -0.923596D+01  0.108747D+02  0.270246D+02  0.115148D+02  0.204903D+01
      5   0.997233D+01 -0.755940D+01  0.293589D+02  0.340831D+01  0.188849D+02
      6   0.537682D+01 -0.540632D+00  0.107142D+02  0.174453D+01  0.748848D+00
               166           167           168           169           170 
      1   0.206649D+02 -0.521039D+01 -0.921734D+01 -0.122362D+02 -0.716604D+01
      2  -0.107686D+02  0.256456D+01  0.156439D+01  0.130384D+01  0.201684D+01
      3  -0.989638D+01  0.264583D+01  0.765295D+01  0.109324D+02  0.514920D+01
      4   0.134201D+02  0.759591D+01  0.113677D+02 -0.606528D+01  0.194247D+01
      5   0.122765D+02  0.121974D+02  0.115889D+02  0.145328D+02  0.388387D+01
      6   0.329999D+01  0.686238D+01  0.124522D+02 -0.531299D+00  0.990438D+01
               171           172           173           174           175 
      1  -0.301958D+02 -0.462806D+02 -0.887899D+01  0.101027D+02 -0.207120D+02
      2  -0.151183D+02  0.259356D+02  0.408218D+01  0.406430D+01  0.137824D+02
      3   0.453141D+02  0.203450D+02  0.479681D+01 -0.141670D+02  0.692964D+01
      4   0.192374D+01 -0.212021D+02 -0.802880D+01 -0.187925D+01 -0.110080D+02
      5   0.454408D+02 -0.216571D+02 -0.471241D+01 -0.150802D+02 -0.122841D+02
      6   0.796022D+01 -0.808746D+01 -0.433382D+01 -0.271038D+01 -0.401174D+01
               176           177           178           179           180 
      1  -0.899821D+01  0.276087D+01 -0.192089D+01  0.574379D+00 -0.115854D+02
      2   0.466294D+01  0.330796D+01  0.758523D+01  0.664487D+00  0.306252D+01
      3   0.433527D+01 -0.606883D+01 -0.566434D+01 -0.123887D+01  0.852292D+01
      4  -0.427335D+01  0.161680D+01 -0.517254D+01 -0.225747D+00 -0.373057D+01
      5   0.597503D+00 -0.908423D+01 -0.841873D+01 -0.164684D+01  0.130019D+01
      6  -0.243762D+01  0.224247D+01 -0.249985D+01  0.150240D+01 -0.211197D+01
               181           182           183           184           185 
      1   0.381547D+02  0.497311D+02 -0.111299D+02 -0.395706D+02  0.188962D+02
      2  -0.246055D+02 -0.380632D+02  0.528748D+01  0.264821D+02 -0.214339D+02
      3  -0.135492D+02 -0.116679D+02  0.584247D+01  0.130884D+02  0.253766D+01
      4   0.107987D+02  0.282739D+02 -0.648153D+01  0.116842D+02  0.252165D+02
      5   0.434814D+00 -0.920150D+01  0.119465D+02  0.312580D+01 -0.102117D+02
      6  -0.167058D+01  0.741039D+01 -0.904148D+01 -0.680218D+01  0.850482D+01
               186           187           188           189           190 
      1  -0.181841D+01  0.733133D+01 -0.903337D+01  0.118134D+01  0.969921D+02
      2   0.391653D+01 -0.132613D+02  0.137020D+02 -0.435650D+01 -0.528664D+02
      3  -0.209812D+01  0.592997D+01 -0.466860D+01  0.317515D+01 -0.441257D+02
      4  -0.105973D+02 -0.861357D+00 -0.134474D+02 -0.203028D+02 -0.125529D+02
      5  -0.455895D+01  0.291217D+02 -0.188390D+02  0.782926D+01  0.611653D+01
      6   0.376020D+01 -0.220781D+02  0.161366D+02 -0.495314D+00 -0.605626D+00
               191           192           193           194           195 
      1  -0.222590D+02 -0.614685D+00 -0.860578D+02 -0.334013D+02  0.156162D+02
      2   0.672304D+01 -0.653219D+00  0.462279D+02  0.381225D+02 -0.152604D+02
      3   0.155359D+02  0.126790D+01  0.398299D+02 -0.472119D+01 -0.355778D+00
      4   0.119585D+02 -0.201878D+01 -0.349258D+02 -0.519171D+02  0.989214D+01
      5  -0.223422D+01  0.774595D-01  0.171463D+02  0.879017D+01 -0.653517D+01
      6   0.289370D+01 -0.182903D+01  0.210155D+01 -0.104696D+02 -0.180658D+01
               196           197           198           199           200 
      1   0.154490D+02  0.106016D+02  0.205369D+02 -0.116406D+03 -0.202193D+01
      2  -0.942574D+01 -0.938151D+01 -0.184822D+02  0.547788D+02  0.852371D+01
      3  -0.602322D+01 -0.122010D+01 -0.205467D+01  0.616273D+02 -0.650178D+01
      4   0.152404D+02  0.548187D+01 -0.802899D+01 -0.760248D+01 -0.228220D+02
      5   0.450757D+02 -0.138321D+02  0.201582D+01  0.321687D+01  0.960964D+01
      6  -0.486390D+01  0.622695D+01  0.318751D+01  0.749770D+01 -0.414926D+01
               201           202           203           204           205 
      1   0.757372D+01  0.113080D+03  0.618362D+01 -0.956708D+01 -0.127970D+02
      2  -0.484173D+01 -0.696933D+02 -0.158232D+02  0.841746D+01  0.102045D+02
      3  -0.273199D+01 -0.433870D+02  0.963954D+01  0.114962D+01  0.259249D+01
      4   0.784631D+01  0.142061D+02  0.199694D+02  0.118676D+01  0.556186D+00
      5   0.521149D+01 -0.361974D+01  0.190400D+01  0.958181D+01  0.605401D+01
      6   0.160248D+01  0.321424D+01  0.924753D+01  0.436761D+01  0.338433D+01
               206           207           208           209           210 
      1  -0.893358D+00 -0.110081D+02  0.326537D+02 -0.664935D+01  0.184063D+01
      2   0.397729D+01 -0.504306D+01 -0.185857D+02  0.340519D+01  0.996994D+00
      3  -0.308393D+01  0.160512D+02 -0.140680D+02  0.324416D+01 -0.283763D+01
      4   0.655689D+01  0.186773D+02 -0.191784D+02  0.115132D+02  0.316543D+01
      5   0.220689D+02 -0.866361D+01  0.980277D+00  0.257259D+01  0.235590D+02
      6   0.746101D+01  0.601913D+00  0.196646D+01 -0.102723D+01  0.899360D+00
               211           212           213           214           215 
      1  -0.576780D+01  0.450154D+01  0.161805D+01  0.876758D+00 -0.684972D+00
      2   0.634483D+00  0.953504D-01  0.283902D+01 -0.206070D+00  0.137425D+01
      3   0.513331D+01 -0.459689D+01 -0.445706D+01 -0.670689D+00 -0.689275D+00
      4   0.344860D+02 -0.218424D+02  0.345363D+01 -0.336133D+01  0.945972D+00
      5  -0.208073D+01  0.513859D+01  0.118007D+02  0.128733D+02 -0.787029D+01
      6  -0.856654D+00  0.286591D+01  0.880528D+01 -0.277876D+01  0.435407D+01
               216           217           218           219           220 
      1   0.260952D+01 -0.742988D+02  0.244449D+02  0.261709D+01  0.274064D+02
      2  -0.250332D+01  0.412175D+02 -0.121937D+02 -0.697579D+00 -0.125929D+02
      3  -0.106206D+00  0.330813D+02 -0.122512D+02 -0.191951D+01 -0.148135D+02
      4  -0.803313D+01  0.308019D+02  0.185575D+02 -0.694445D+01 -0.173555D+02
      5  -0.214512D+01  0.114690D+01 -0.672631D+01  0.100027D+02 -0.709035D+01
      6  -0.196224D+01 -0.360827D+01 -0.111996D+01  0.261670D+01 -0.353370D+01
               221           222           223           224           225 
      1   0.469761D+01 -0.867291D+01 -0.952814D+00 -0.559267D+01  0.136389D+02
      2  -0.449990D+01 -0.497355D+01 -0.483910D+01 -0.335340D+01 -0.481262D+01
      3  -0.197710D+00  0.136465D+02  0.579191D+01  0.894607D+01 -0.882626D+01
      4  -0.107776D+02 -0.191283D+02 -0.618718D+01 -0.163551D+02 -0.391178D+02
      5  -0.197008D+02 -0.632476D+02 -0.155172D+02 -0.375835D+02  0.262193D+02
      6  -0.476137D+01 -0.161384D+02 -0.995341D+01 -0.109968D+02  0.798237D+01
               226           227           228           229           230 
      1  -0.898045D+01 -0.184709D+02  0.423962D+01 -0.101859D+02 -0.482944D+02
      2   0.954755D+01  0.197602D+02 -0.321813D+01  0.112931D+02  0.573682D+02
      3  -0.567102D+00 -0.128925D+01 -0.102149D+01 -0.110725D+01 -0.907384D+01
      4   0.405578D+01  0.688800D+01 -0.112403D+01  0.295583D+01 -0.392245D+01
      5  -0.451429D+00 -0.669056D+00  0.113078D+01  0.890817D-01  0.220719D+01
      6  -0.275685D+01 -0.500940D+01  0.351310D+01 -0.289843D+01 -0.137817D+02
               231           232           233           234           235 
      1   0.962155D+01  0.257557D+01  0.100113D+02 -0.278811D+01  0.178969D+02
      2  -0.864639D+01 -0.279137D+01 -0.102773D+02  0.288491D+01  0.185778D+01
      3  -0.975159D+00  0.215799D+00  0.266032D+00 -0.968059D-01 -0.197546D+02
      4   0.101657D+01 -0.381696D+00  0.695501D+00  0.100082D+01 -0.391595D+02
      5  -0.147708D+01  0.208290D+01  0.259017D-01 -0.217172D+00  0.640001D+01
      6   0.888730D+01  0.221796D+00  0.580447D+01 -0.294702D+01 -0.290530D+01
               236           237           238           239           240 
      1  -0.105007D+02  0.116454D+01 -0.740913D+01 -0.429810D+01  0.377754D+00
      2  -0.722592D+01  0.646762D-01 -0.142576D+02  0.321002D+02 -0.206143D+01
      3   0.177266D+02 -0.122922D+01  0.216667D+02 -0.278021D+02  0.168367D+01
      4   0.384722D+02 -0.401830D+01  0.453457D+02 -0.626948D+02  0.710724D+01
      5  -0.559762D+01  0.543713D+01 -0.806750D+01  0.975664D+01 -0.746952D+01
      6   0.306632D+01 -0.352461D+01  0.616986D+01 -0.804057D+01  0.706404D+01
               241           242           243           244           245 
      1  -0.126715D-01  0.929967D+00 -0.163136D+01  0.181822D+02  0.115665D+02
      2   0.304536D+01 -0.366307D+01  0.240073D+01 -0.712677D+01 -0.366608D+01
      3  -0.303269D+01  0.273311D+01 -0.769375D+00 -0.110554D+02 -0.790039D+01
      4  -0.574087D+01  0.774665D+01 -0.461162D+01  0.209492D+02  0.154635D+02
      5   0.871037D+00 -0.401748D+01  0.209023D+01 -0.464749D+01 -0.300632D+01
      6  -0.174766D+00  0.427189D+01 -0.207732D+01 -0.115377D+01 -0.112980D+01
               246           247           248           249           250 
      1  -0.322093D+01  0.139619D+02 -0.533373D+00 -0.665208D+00 -0.383760D+01
      2   0.154579D+01 -0.955261D+00  0.116849D+02 -0.490957D+00  0.147776D+01
      3   0.167515D+01 -0.130066D+02 -0.111515D+02  0.115616D+01  0.235985D+01
      4  -0.368587D+01  0.264336D+02  0.364693D+02 -0.719261D+01 -0.597049D+01
      5   0.273900D+01 -0.502751D+01 -0.576171D+01  0.532077D+01  0.189878D+01
      6   0.113805D+01 -0.247160D+01 -0.409433D+01  0.435877D+01  0.226035D+01
               251           252           253           254           255 
      1  -0.101312D+01 -0.890354D+00 -0.368650D+01 -0.688247D-01 -0.112872D+02
      2  -0.103613D+01  0.168830D+01  0.119856D+01 -0.303212D+00  0.319647D+01
      3   0.204925D+01 -0.797946D+00  0.248794D+01  0.372036D+00  0.809070D+01
      4  -0.754606D+01  0.223499D+01 -0.411889D+01 -0.297199D+01 -0.247866D+00
      5   0.674158D+00 -0.106946D+01 -0.627328D+01  0.192638D+00 -0.722708D+01
      6   0.199988D+01 -0.172184D+01 -0.104897D+01  0.983193D+00 -0.291168D+01
               256           257           258           259           260 
      1   0.512724D+01  0.107845D+01  0.507968D+00 -0.309473D+02 -0.309525D+01
      2  -0.295845D+01  0.169712D+00  0.942052D+00  0.215473D+02  0.336444D+01
      3  -0.216879D+01 -0.124816D+01 -0.145002D+01  0.939994D+01 -0.269189D+00
      4   0.172085D+02  0.174999D+02 -0.167815D+02 -0.182592D+02 -0.164037D+02
      5  -0.117969D+02 -0.153192D+02  0.271762D+02  0.351026D+02  0.231567D+02
      6  -0.437656D+01 -0.666449D+01  0.114299D+02  0.932549D+01  0.981183D+01
               261           262           263           264           265 
      1  -0.226969D+01  0.205318D+03 -0.153764D+02 -0.810964D+01 -0.419091D+02
      2  -0.128258D+02 -0.108055D+03  0.887577D+01  0.513627D+01  0.229967D+02
      3   0.150955D+02 -0.972627D+02  0.650058D+01  0.297337D+01  0.189124D+02
      4   0.254845D+02 -0.608099D+01  0.149674D+02  0.955212D+00  0.201164D+02
      5  -0.663279D+02 -0.119320D+02  0.157940D+01  0.170780D+02  0.335480D+01
      6  -0.161765D+02  0.190821D+01 -0.836026D+00  0.577241D+00 -0.137150D+01
               266           267           268           269           270 
      1   0.184644D+02  0.203096D+01 -0.295696D+01  0.641821D+00  0.151731D+02
      2  -0.908221D+01 -0.934429D+00  0.261059D+01  0.131855D+00 -0.917245D+01
      3  -0.938218D+01 -0.109653D+01  0.346367D+00 -0.773677D+00 -0.600068D+01
      4  -0.992059D+01  0.679401D+00  0.111023D+01  0.161417D+01  0.185974D+01
      5   0.351604D+00 -0.221084D+01  0.227640D+02  0.101170D+01 -0.401585D+01
      6   0.106610D+01  0.147388D+01  0.445945D+00  0.195430D+01 -0.345359D+00
               271           272           273           274           275 
      1   0.427552D+01  0.467477D+01  0.944355D+01  0.207393D+02  0.841916D+01
      2  -0.108282D+01 -0.248499D+01 -0.498317D+01 -0.595167D+01  0.506400D+01
      3  -0.319270D+01 -0.218978D+01 -0.446037D+01 -0.147877D+02 -0.134832D+02
      4   0.242266D+01  0.824305D+00  0.250166D+01  0.346974D+02  0.422466D+02
      5   0.949875D+01  0.152093D+01 -0.385878D+01  0.159060D+02  0.248987D+02
      6   0.198357D+01 -0.110747D+00 -0.194262D+01  0.618204D+01  0.886650D+01
               276           277           278           279 
      1   0.313360D+01  0.334926D+02  0.742203D+01  0.115149D+01
      2   0.331592D+01 -0.151081D+02 -0.172723D+00 -0.181144D+01
      3  -0.644952D+01 -0.183845D+02 -0.724930D+01  0.659951D+00
      4   0.253435D+02  0.254452D+02  0.271362D+02  0.268308D+02
      5   0.285830D+02  0.238206D+02  0.259740D+02  0.356890D+02
      6   0.958741D+01  0.849286D+01  0.948870D+01  0.101392D+02
 Leave Link  716 at Thu Aug 12 21:39:36 2021, MaxMem=  5368709120 cpu:               0.4 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l9999.exe)
 AllDun F.D. properties on file 20721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) frequency  1    0.088559:
                 1             2             3 
      1   0.303178D+03 -0.125945D+02 -0.102746D+02
      2  -0.125945D+02  0.177410D+03 -0.850368D+01
      3  -0.102746D+02 -0.850368D+01  0.120356D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.088559:
                 1             2             3 
      1  -0.111415D+02  0.194338D+02 -0.152319D+02
      2  -0.264150D+02 -0.132530D+02 -0.312428D+02
      3   0.499098D+02 -0.586642D+02  0.215607D+02
 Property number 4 -- D-Q polarizability frequency  1    0.088559:
                 1             2             3 
      1   0.333339D+03 -0.957881D+02 -0.139768D+02
      2  -0.146176D+03  0.769781D+02 -0.115842D+02
      3  -0.187163D+03  0.188100D+02  0.255610D+02
      4  -0.190629D+02  0.123732D+03 -0.444837D+02
      5   0.465371D+02 -0.531838D+02 -0.656365D+02
      6  -0.262387D+02  0.405523D+02  0.247900D+02
 AllDun F.D. properties on file 20722 Mask=       B NFrqRd=     1 NDeriv=    93 ND12= 1 LenFil=    3351:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.383744D+02  0.715836D+01  0.639873D+00 -0.353646D+02  0.106218D+02
      2   0.715836D+01 -0.338920D+01  0.867179D-01  0.106218D+02 -0.105763D+02
      3   0.639873D+00  0.867179D-01  0.110648D+00  0.145251D+00  0.114332D+01
                 6             7             8             9            10 
      1   0.145251D+00  0.941777D+01 -0.270299D+01 -0.799103D+00  0.466665D+02
      2   0.114332D+01 -0.270299D+01  0.175346D+01 -0.121312D+01 -0.103133D+02
      3   0.100254D+00 -0.799103D+00 -0.121312D+01  0.551895D+00 -0.733381D+00
                11            12            13            14            15 
      1  -0.103133D+02 -0.733381D+00  0.325231D+02 -0.888950D+01 -0.867073D-01
      2   0.696838D+01 -0.680623D+00 -0.888950D+01  0.853584D+01 -0.839936D+00
      3  -0.680623D+00 -0.146941D+00 -0.867073D-01 -0.839936D+00 -0.577068D-01
                16            17            18            19            20 
      1  -0.907375D+01  0.263758D+01  0.148025D+01  0.365638D+02 -0.740524D+01
      2   0.263758D+01 -0.174084D+01  0.958607D+00 -0.740524D+01  0.499295D+01
      3   0.148025D+01  0.958607D+00 -0.314372D+00 -0.284261D+00 -0.580804D+00
                21            22            23            24            25 
      1  -0.284261D+00 -0.281000D+02  0.428296D+01 -0.217916D+00  0.392940D+01
      2  -0.580804D+00  0.428296D+01 -0.558906D+01 -0.183052D+00 -0.854122D+00
      3   0.287781D+00 -0.217916D+00 -0.183052D+00 -0.189996D+01 -0.123135D+01
                26            27            28            29            30 
      1  -0.854122D+00 -0.123135D+01 -0.521906D+02  0.635133D+01  0.670632D+00
      2  -0.359253D+00 -0.288019D+01  0.635133D+01 -0.348457D+01 -0.244817D+00
      3  -0.288019D+01  0.174809D+01  0.670632D+00 -0.244817D+00 -0.223939D+01
                31            32            33            34            35 
      1   0.135273D+02 -0.192604D+01 -0.129379D+01 -0.442636D+01 -0.795467D+00
      2  -0.192604D+01  0.967941D+01 -0.139846D+01 -0.795467D+00 -0.871897D+00
      3  -0.129379D+01 -0.139846D+01  0.473649D+00 -0.671966D+01  0.118835D+01
                36            37            38            39            40 
      1  -0.671966D+01  0.183394D+01 -0.545603D+00  0.147307D+00  0.134128D+02
      2   0.118835D+01 -0.545603D+00 -0.980270D+01  0.168195D+01 -0.223751D+01
      3   0.383876D+00  0.147307D+00  0.168195D+01 -0.171137D+01 -0.618339D+00
                41            42            43            44            45 
      1  -0.223751D+01 -0.618339D+00 -0.319792D+01 -0.321576D+00 -0.504579D+01
      2  -0.116360D+01  0.132667D+01 -0.321576D+00  0.223504D+01  0.326573D+01
      3   0.132667D+01  0.153357D+01 -0.504579D+01  0.326573D+01 -0.875367D+00
                46            47            48            49            50 
      1   0.390083D+01 -0.159304D+01  0.107436D+00  0.285430D+01 -0.242416D+01
      2  -0.159304D+01  0.769875D+01 -0.596815D+00 -0.242416D+01  0.227435D+00
      3   0.107436D+00 -0.596815D+00  0.167828D+01  0.627391D+00  0.104748D+01
                51            52            53            54            55 
      1   0.627391D+00 -0.419973D+00  0.846491D+00  0.110618D+01 -0.111756D+02
      2   0.104748D+01  0.846491D+00  0.969384D+00  0.379934D+01  0.427010D+01
      3   0.742214D+00  0.110618D+01  0.379934D+01 -0.181821D+01 -0.198886D+00
                56            57            58            59            60 
      1   0.427010D+01 -0.198886D+00  0.222709D+01  0.119516D+00 -0.670277D+00
      2  -0.104479D+02  0.116333D+01  0.119516D+00  0.129791D+01 -0.115433D+01
      3   0.116333D+01 -0.166930D+01 -0.670277D+00 -0.115433D+01 -0.777561D+00
                61            62            63            64            65 
      1  -0.552853D-01 -0.912404D+00 -0.149086D+01 -0.244762D+01 -0.237245D+01
      2  -0.912404D+00 -0.824048D+00 -0.345681D+01 -0.237245D+01 -0.143679D+01
      3  -0.149086D+01 -0.345681D+01  0.193674D+01  0.583656D+00  0.330528D+00
                66            67            68            69            70 
      1   0.583656D+00 -0.322811D+01 -0.301892D+01  0.778436D+00  0.927577D+00
      2   0.330528D+00 -0.301892D+01 -0.504121D+01  0.102464D+01  0.727497D+00
      3  -0.440195D+00  0.778436D+00  0.102464D+01 -0.937312D+00 -0.209127D+00
                71            72            73            74            75 
      1   0.727497D+00 -0.209127D+00 -0.457032D+01  0.326814D+01 -0.247591D+00
      2   0.956937D+00 -0.337411D+00  0.326814D+01 -0.346171D+01  0.357772D+00
      3  -0.337411D+00  0.253822D+00 -0.247591D+00  0.357772D+00 -0.331532D+00
                76            77            78            79            80 
      1   0.359676D+01 -0.468597D+01  0.675828D+00 -0.313289D+00  0.743954D+00
      2  -0.468597D+01  0.800758D+01 -0.909556D+00  0.743954D+00 -0.113161D+01
      3   0.675828D+00 -0.909556D+00  0.808297D+00  0.357774D+00  0.343027D+00
                81            82            83            84            85 
      1   0.357774D+00  0.159685D+01  0.222260D+01 -0.481666D+00  0.117941D+01
      2   0.343027D+00  0.222260D+01  0.326876D+01 -0.665411D+00  0.251144D+01
      3  -0.226700D+00 -0.481666D+00 -0.665411D+00  0.434375D+00 -0.438528D+00
                86            87            88            89            90 
      1   0.251144D+01 -0.438528D+00 -0.232597D+00 -0.524391D+00  0.248657D+00
      2   0.916812D+01 -0.163783D+01 -0.524391D+00 -0.188438D+01  0.478062D+00
      3  -0.163783D+01  0.108617D+01  0.248657D+00  0.478062D+00 -0.299190D+00
                91            92            93            94            95 
      1   0.192773D+02 -0.190273D+01  0.291446D+00  0.579630D+01  0.875788D+00
      2  -0.190273D+01  0.170191D+01  0.736658D+00  0.875788D+00 -0.359892D+01
      3   0.291446D+00  0.736658D+00  0.311476D+01  0.436330D+00  0.183532D+01
                96            97            98            99           100 
      1   0.436330D+00 -0.243238D+01  0.142257D+01  0.842470D+01  0.942805D+01
      2   0.183532D+01  0.142257D+01  0.167212D+01 -0.930056D-01 -0.702894D+00
      3   0.118988D+01  0.842470D+01 -0.930056D-01 -0.166346D+01 -0.213403D+01
               101           102           103           104           105 
      1  -0.702894D+00 -0.213403D+01 -0.288970D+01 -0.160394D+01 -0.108510D+00
      2  -0.169338D+01 -0.542344D+00 -0.160394D+01  0.139870D+01 -0.355661D+01
      3  -0.542344D+00 -0.241006D+01 -0.108510D+00 -0.355661D+01 -0.155560D+01
               106           107           108           109           110 
      1   0.660288D+01 -0.105764D+01 -0.559574D+01  0.706796D+01  0.374881D+01
      2  -0.105764D+01 -0.235139D+01 -0.660418D+00  0.374881D+01  0.128547D+01
      3  -0.559574D+01 -0.660418D+00  0.269831D+01 -0.109536D+01 -0.276710D+00
               111           112           113           114           115 
      1  -0.109536D+01  0.832477D+00  0.146261D+01 -0.817001D+00 -0.981006D+01
      2  -0.276710D+00  0.146261D+01  0.654292D+00 -0.829747D+00 -0.146647D+01
      3  -0.102388D+01 -0.817001D+00 -0.829747D+00 -0.281410D+00 -0.444482D+01
               116           117           118           119           120 
      1  -0.146647D+01 -0.444482D+01 -0.521970D+00  0.211508D+01 -0.639597D+00
      2  -0.160187D+01 -0.109412D+00  0.211508D+01 -0.187844D+01  0.203561D-01
      3  -0.109412D+00  0.302193D+00 -0.639597D+00  0.203561D-01 -0.117826D+01
               121           122           123           124           125 
      1   0.429163D+01 -0.227827D+01  0.195818D+00 -0.125362D+01  0.149897D+00
      2  -0.227827D+01  0.601336D+01 -0.950107D+00  0.149897D+00 -0.132708D+01
      3   0.195818D+00 -0.950107D+00  0.137780D+01 -0.147239D+01  0.107524D+01
               126           127           128           129           130 
      1  -0.147239D+01  0.108829D+00 -0.641012D+00  0.171983D+00 -0.195822D+01
      2   0.107524D+01 -0.641012D+00  0.755946D+00 -0.262524D+00  0.235032D-01
      3  -0.426834D+00  0.171983D+00 -0.262524D+00  0.125503D+01  0.592389D+00
               131           132           133           134           135 
      1   0.235032D-01  0.592389D+00  0.203448D+00  0.113280D+00  0.241628D+00
      2  -0.397830D+01  0.222669D+01  0.113280D+00  0.154137D+01 -0.122795D+01
      3   0.222669D+01 -0.262728D+01  0.241628D+00 -0.122795D+01  0.181100D+01
               136           137           138           139           140 
      1  -0.163787D+02  0.847423D+00  0.395162D+01  0.477800D+00 -0.124959D+01
      2   0.847423D+00 -0.858932D+00 -0.308247D+00 -0.124959D+01  0.673802D-01
      3   0.395162D+01 -0.308247D+00 -0.247927D+01 -0.262306D+00  0.708985D+00
               141           142           143           144           145 
      1  -0.262306D+00  0.121994D+01  0.980015D-01 -0.122573D+01 -0.205015D+00
      2   0.708985D+00  0.980015D-01  0.100885D+00  0.107169D+00  0.813977D+00
      3   0.186711D+00 -0.122573D+01  0.107169D+00  0.373712D+00  0.769392D+00
               146           147           148           149           150 
      1   0.813977D+00  0.769392D+00  0.140837D+01  0.132483D+00 -0.280998D+00
      2   0.100120D+01  0.829524D+00  0.132483D+00  0.303760D+01  0.284810D+01
      3   0.829524D+00  0.200701D+01 -0.280998D+00  0.284810D+01  0.361514D+01
               151           152           153           154           155 
      1   0.542689D-01  0.587968D-01  0.266049D+00 -0.183234D+02 -0.466503D+01
      2   0.587968D-01  0.207617D+01  0.236699D+01 -0.466503D+01 -0.269885D+01
      3   0.266049D+00  0.236699D+01  0.444573D+01  0.405936D+00 -0.380449D+00
               156           157           158           159           160 
      1   0.405936D+00 -0.820247D+01 -0.551576D+01  0.264602D+00  0.872359D+00
      2  -0.380449D+00 -0.551576D+01 -0.406272D+01  0.308242D+00  0.507958D+00
      3  -0.266201D+01  0.264602D+00  0.308242D+00 -0.128671D+01 -0.221851D+01
               161           162           163           164           165 
      1   0.507958D+00 -0.221851D+01 -0.139115D+02 -0.285584D+01 -0.354575D+01
      2   0.973345D+00 -0.100032D+01 -0.285584D+01 -0.338324D+00  0.545982D-01
      3  -0.100032D+01  0.128158D+01 -0.354575D+01  0.545982D-01 -0.135141D+01
               166           167           168           169           170 
      1  -0.700119D+01 -0.861054D+00 -0.110532D+01  0.147371D+01  0.312091D+00
      2  -0.861054D+00 -0.850197D+00 -0.167973D+01  0.312091D+00 -0.306719D+00
      3  -0.110532D+01 -0.167973D+01 -0.209876D+01 -0.654133D+00 -0.106295D+01
               171           172           173           174           175 
      1  -0.654133D+00  0.113140D+02  0.235453D+01  0.157830D+01  0.785898D+01
      2  -0.106295D+01  0.235453D+01  0.648236D+00  0.402330D+00  0.870051D+00
      3  -0.718592D+01  0.157830D+01  0.402330D+00  0.301126D+01  0.139610D+01
               176           177           178           179           180 
      1   0.870051D+00  0.139610D+01  0.490217D+01  0.488498D+00  0.198265D+01
      2   0.384899D+00 -0.530814D+00  0.488498D+00 -0.915109D+00  0.522086D+00
      3  -0.530814D+00  0.155425D+01  0.198265D+01  0.522086D+00 -0.119512D+01
               181           182           183           184           185 
      1   0.107172D+02 -0.135985D+01 -0.808407D-01 -0.905644D+01  0.203028D+01
      2  -0.135985D+01  0.109681D+02 -0.200685D+01  0.203028D+01  0.272849D+01
      3  -0.808407D-01 -0.200685D+01  0.194344D+01  0.928606D+00 -0.159000D+01
               186           187           188           189           190 
      1   0.928606D+00  0.148235D+01  0.310000D+00  0.449486D+01  0.316669D+02
      2  -0.159000D+01  0.310000D+00 -0.264698D+01 -0.326438D+01 -0.542492D+01
      3  -0.103974D+01  0.449486D+01 -0.326438D+01  0.794240D+00 -0.312109D+00
               191           192           193           194           195 
      1  -0.542492D+01 -0.312109D+00 -0.211666D+02  0.254042D+01  0.198542D+01
      2   0.566802D+01 -0.322706D+00  0.254042D+01 -0.140419D+02  0.205267D+01
      3  -0.322706D+00  0.271656D+01  0.198542D+01  0.205267D+01 -0.140704D+01
               196           197           198           199           200 
      1   0.257369D+01  0.994624D+00  0.631136D+01 -0.380524D+02  0.917054D+01
      2   0.994624D+00  0.153678D+01 -0.209093D+01  0.917054D+01 -0.844528D+01
      3   0.631136D+01 -0.209093D+01 -0.134882D+00  0.605230D+00  0.135230D+01
               201           202           203           204           205 
      1   0.605230D+00  0.253231D+02 -0.333396D+01 -0.691855D+00 -0.186363D+01
      2   0.135230D+01 -0.333396D+01  0.716994D+01 -0.694017D-01  0.339953D+00
      3  -0.934528D-01 -0.691855D+00 -0.694017D-01  0.212070D+01  0.591188D+00
               206           207           208           209           210 
      1   0.339953D+00  0.591188D+00 -0.449447D+01 -0.410748D-01  0.305459D+00
      2   0.647480D+00  0.350686D+01 -0.410748D-01 -0.242224D+01  0.415684D+00
      3   0.350686D+01 -0.184505D+01  0.305459D+00  0.415684D+00 -0.591005D-01
               211           212           213           214           215 
      1   0.112643D+01  0.197783D+01 -0.260408D+00  0.202352D+00 -0.322884D+00
      2   0.197783D+01 -0.189677D+01  0.312361D+00 -0.322884D+00  0.319508D+00
      3  -0.260408D+00  0.312361D+00  0.104259D+01  0.470256D+00 -0.623812D+00
               216           217           218           219           220 
      1   0.470256D+00 -0.313385D+00  0.227998D+01 -0.397542D+00  0.211838D+01
      2  -0.623812D+00  0.227998D+01  0.243047D+01 -0.659335D+00 -0.182461D+01
      3  -0.436532D-01 -0.397542D+00 -0.659335D+00  0.142734D+01 -0.565464D+00
               221           222           223           224           225 
      1  -0.182461D+01 -0.565464D+00 -0.620497D+00 -0.447472D+00 -0.164564D+01
      2   0.312095D+00 -0.177078D+01 -0.447472D+00 -0.169472D+01 -0.348904D+01
      3  -0.177078D+01 -0.543038D+01 -0.164564D+01 -0.348904D+01  0.257802D+01
               226           227           228           229           230 
      1  -0.120745D+01 -0.179975D+01  0.410121D+00 -0.585203D+00 -0.196528D+01
      2  -0.179975D+01 -0.329775D+01  0.660313D+00 -0.196528D+01 -0.882630D+01
      3   0.410121D+00  0.660313D+00 -0.443809D+00  0.387311D+00  0.157776D+01
               231           232           233           234           235 
      1   0.387311D+00  0.229686D+00  0.494001D+00  0.861749D-01  0.492706D+01
      2   0.157776D+01  0.494001D+00  0.172497D+01 -0.598255D+00 -0.397512D+01
      3  -0.110195D+01  0.861749D-01 -0.598255D+00  0.317172D+00  0.408793D+00
               236           237           238           239           240 
      1  -0.397512D+01  0.408793D+00 -0.462763D+01  0.547619D+01 -0.804124D+00
      2   0.410369D+01 -0.418439D+00  0.547619D+01 -0.831732D+01  0.957264D+00
      3  -0.418439D+00  0.520762D+00 -0.804124D+00  0.957264D+00 -0.944858D+00
               241           242           243           244           245 
      1   0.482433D+00 -0.779634D+00 -0.159904D+00  0.304320D+01  0.252499D+01
      2  -0.779634D+00  0.111825D+01 -0.417649D+00  0.252499D+01  0.144914D+01
      3  -0.159904D+00 -0.417649D+00  0.278310D+00 -0.645540D+00 -0.391794D+00
               246           247           248           249           250 
      1  -0.645540D+00  0.394708D+01  0.313214D+01 -0.777617D+00 -0.913665D+00
      2  -0.391794D+00  0.313214D+01  0.517643D+01 -0.105564D+01 -0.735392D+00
      3   0.298619D+00 -0.777617D+00 -0.105564D+01  0.767682D+00  0.223346D+00
               251           252           253           254           255 
      1  -0.735392D+00  0.223346D+00 -0.126192D+01 -0.449547D+00 -0.448584D+00
      2  -0.106497D+01  0.157888D+00 -0.449547D+00 -0.228495D+00  0.115876D+00
      3   0.157888D+00 -0.133024D+00 -0.448584D+00  0.115876D+00 -0.109554D+01
               256           257           258           259           260 
      1   0.778421D+00  0.145489D+01 -0.102642D+01 -0.392521D+01 -0.143244D+01
      2   0.145489D+01  0.138847D+01 -0.152884D+01 -0.143244D+01 -0.136563D+01
      3  -0.102642D+01 -0.152884D+01  0.248057D+01  0.306206D+01  0.221877D+01
               261           262           263           264           265 
      1   0.306206D+01  0.158182D+02 -0.112057D+01 -0.692064D+00 -0.373129D+01
      2   0.221877D+01 -0.112057D+01  0.954658D+00  0.115550D+00  0.146202D+01
      3  -0.653851D+01 -0.692064D+00  0.115550D+00  0.110588D+01  0.265081D+00
               266           267           268           269           270 
      1   0.146202D+01  0.265081D+00 -0.214589D+00  0.112164D+00  0.155724D+01
      2  -0.795465D+00  0.659719D-01  0.112164D+00  0.151139D+00  0.153125D+00
      3   0.659719D-01 -0.139936D+00  0.155724D+01  0.153125D+00 -0.337295D+00
               271           272           273           274           275 
      1  -0.501741D+00  0.420913D-01  0.890022D+00  0.263167D+01  0.284065D+01
      2   0.420913D-01 -0.111146D-01  0.143757D-01  0.284065D+01  0.349007D+01
      3   0.890022D+00  0.143757D-01 -0.576227D+00  0.134701D+01  0.224933D+01
               276           277           278           279 
      1   0.134701D+01  0.417878D+01  0.199553D+01  0.200837D+01
      2   0.224933D+01  0.199553D+01  0.230964D+01  0.238441D+01
      3   0.250674D+01  0.200837D+01  0.238441D+01  0.328290D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1   0.324788D+01  0.220748D+01 -0.315645D+00  0.355882D+01 -0.191797D+01
      2   0.783895D+01  0.400119D+01 -0.206069D+00  0.789733D+01 -0.513759D+01
      3   0.454067D+01  0.241492D+02 -0.528657D+01  0.277297D+02 -0.243322D+02
                 6             7             8             9            10 
      1   0.160105D+00 -0.582550D+01  0.835575D+01 -0.148611D+01 -0.969628D+00
      2   0.202927D+01 -0.207840D+02  0.411268D+01 -0.879573D-02 -0.654737D+01
      3   0.280523D+01 -0.118927D+01  0.147914D+01  0.275340D+00  0.272855D+02
                11            12            13            14            15 
      1   0.296573D+01 -0.946220D+00 -0.788745D+00  0.792953D+00  0.340025D+00
      2   0.445064D+01 -0.514856D+01  0.127460D+01 -0.421649D+01  0.750296D+00
      3   0.175638D+02 -0.402915D+01  0.563656D+02 -0.331069D+02  0.289978D+01
                16            17            18            19            20 
      1  -0.626937D+01  0.872238D+01 -0.132209D+01 -0.380211D+01 -0.829905D+00
      2  -0.203290D+02  0.368251D+01  0.992333D+00 -0.943279D+01 -0.343792D+01
      3  -0.777362D+01  0.388190D+01  0.377175D+00 -0.600070D+00 -0.265284D+02
                21            22            23            24            25 
      1   0.332011D+00 -0.465325D+00  0.281113D+00 -0.133049D+01 -0.865010D+01
      2   0.399951D+00  0.243482D+01  0.210637D+01  0.113771D+01 -0.189097D+02
      3   0.555531D+01 -0.595987D+01  0.575306D+01 -0.223326D+01  0.663793D+01
                26            27            28            29            30 
      1   0.439856D+01 -0.112677D+01  0.670225D+00  0.172775D+01  0.484828D+00
      2   0.871846D+01 -0.756454D+00  0.763499D+01  0.206223D+01  0.950220D+00
      3  -0.209383D+01 -0.800271D+00 -0.263477D+02  0.132156D+02 -0.170540D+01
                31            32            33            34            35 
      1   0.576945D+01  0.366963D+01  0.113537D+01  0.382908D+01  0.135993D+02
      2   0.278845D+00  0.207097D+00  0.437171D+00 -0.137927D+02  0.809190D+00
      3   0.314019D+02 -0.256614D+01 -0.119509D+01 -0.191764D+01 -0.269031D+01
                36            37            38            39            40 
      1  -0.224110D+01  0.576385D-02 -0.362074D+00  0.444594D+01  0.133395D+01
      2   0.775780D+00 -0.383841D+01 -0.937414D+00  0.178159D+00 -0.346284D+01
      3  -0.236253D+01 -0.780385D+01 -0.250989D+01 -0.668237D-01  0.131585D+02
                41            42            43            44            45 
      1  -0.104066D+01 -0.278385D+01  0.174883D+02  0.119432D+01 -0.211096D+00
      2  -0.338676D+01 -0.174103D+01 -0.102537D+02 -0.668754D+01  0.252939D+01
      3  -0.720986D+01  0.256992D+00 -0.388920D+01  0.164123D+01 -0.598427D+01
                46            47            48            49            50 
      1  -0.802907D+00 -0.181958D+01 -0.472740D+01 -0.276287D+01  0.677307D+00
      2   0.412037D+01 -0.336796D+01  0.234414D+01 -0.590518D+01  0.545797D+01
      3   0.222025D+02 -0.227028D+02  0.346671D+01 -0.985268D+01  0.245566D+02
                51            52            53            54            55 
      1  -0.212000D+01 -0.117468D+02 -0.250001D+01  0.309677D+01  0.168393D+01
      2  -0.909898D+00 -0.155737D+02  0.151003D+01  0.121984D+01  0.551334D+01
      3  -0.292438D+01  0.389775D+01 -0.246725D+01  0.534602D+01  0.325245D+02
                56            57            58            59            60 
      1  -0.367158D+01 -0.420360D+01 -0.243552D+01  0.135116D+01 -0.162170D+01
      2  -0.389055D+01 -0.297273D+01 -0.560701D+01  0.397943D+01 -0.189960D+01
      3  -0.125653D+02  0.226124D+01 -0.730087D+01  0.256353D+02 -0.163802D+01
                61            62            63            64            65 
      1  -0.117602D+02 -0.230045D+01  0.210586D+01 -0.239778D+00 -0.507336D+00
      2  -0.212855D+02 -0.202466D+01  0.516405D+01  0.111177D+01  0.796617D+00
      3   0.502689D+01 -0.109536D+01  0.128750D+02  0.184125D+01 -0.281008D-01
                66            67            68            69            70 
      1  -0.167142D+01 -0.725050D+00 -0.149685D+01 -0.274203D+01 -0.595216D+00
      2   0.495652D+00  0.112832D+01 -0.296554D-01  0.182176D+01 -0.241095D+01
      3   0.242706D-02  0.322691D+01 -0.513378D+01  0.846496D+00 -0.197998D+00
                71            72            73            74            75 
      1   0.220499D+01  0.386745D+00 -0.298794D+00  0.195733D+00  0.210134D+01
      2  -0.897079D+00  0.120008D-01 -0.745422D+00 -0.154224D+00  0.131138D+01
      3   0.857029D+00  0.580471D+00 -0.834830D+01  0.158302D+01  0.310796D-02
                76            77            78            79            80 
      1  -0.112750D+01  0.835713D+00 -0.394614D+01 -0.295261D+01  0.156059D+01
      2  -0.431929D+00  0.702954D+00 -0.229271D+01 -0.157450D+01 -0.150045D+00
      3   0.396229D+01  0.148279D+01  0.386249D+00  0.376362D+00 -0.416232D+00
                81            82            83            84            85 
      1   0.488854D+00  0.812755D+00  0.553464D+00 -0.200910D+01  0.667323D+00
      2   0.526880D+00  0.989613D+00  0.496840D+00  0.100531D+01  0.674731D+00
      3   0.128249D+01  0.698359D+01  0.334363D+01 -0.122283D+01  0.527333D+01
                86            87            88            89            90 
      1   0.140386D+01 -0.449492D+01  0.102918D+01  0.187441D+01  0.453597D+00
      2   0.739353D+00  0.138841D+01 -0.924568D+00  0.636377D+00 -0.659371D+00
      3   0.395665D+01 -0.120285D+01 -0.110806D+01 -0.142600D+01 -0.518133D+00
                91            92            93            94            95 
      1   0.290042D+01  0.939834D+00 -0.172975D+01  0.562285D+01 -0.752320D+00
      2  -0.785084D+01 -0.209347D+01 -0.655099D+01 -0.287073D+01 -0.866688D+01
      3   0.152278D+02 -0.161597D+01  0.283139D+01  0.227101D+02 -0.197563D+02
                96            97            98            99           100 
      1  -0.230720D+01 -0.284630D+01  0.537827D+01  0.128124D+01  0.182811D+01
      2  -0.262918D+01 -0.360738D+02  0.199519D+00  0.362192D+01 -0.120894D+02
      3   0.798999D+01  0.124507D+01  0.113250D+02  0.842158D+01  0.167657D+01
               101           102           103           104           105 
      1  -0.626010D+01  0.409567D+00 -0.258983D+01  0.422165D+01 -0.114725D+02
      2   0.205324D+01  0.174935D+02 -0.523100D+00  0.188613D+02  0.648278D+01
      3  -0.140637D+02 -0.142860D+01 -0.926069D+01  0.864516D+01 -0.157711D+02
               106           107           108           109           110 
      1   0.317568D+01 -0.579317D+01 -0.529170D+01 -0.534390D+01  0.941956D+00
      2   0.176777D+02  0.271016D+01 -0.424633D+01  0.136437D+02  0.446131D+01
      3   0.572738D+01 -0.148327D+02 -0.761096D+01 -0.565995D+01  0.106136D+02
               111           112           113           114           115 
      1   0.979636D+01 -0.115996D+02 -0.666496D+01 -0.833267D+01  0.946590D+01
      2   0.245816D+01  0.592174D+01  0.405440D+01 -0.101025D+02  0.862312D+01
      3  -0.668877D+01  0.909478D+01  0.177770D+02 -0.193663D+01 -0.183303D+02
               116           117           118           119           120 
      1   0.920801D-02  0.585699D+01  0.124594D+01 -0.109727D+01  0.101750D+01
      2  -0.207141D+01  0.207720D+01  0.278834D+01 -0.977676D+00  0.501008D+01
      3  -0.626023D+01 -0.516262D+01  0.929779D+01 -0.638137D+01 -0.239947D+00
               121           122           123           124           125 
      1  -0.132263D+01  0.248996D+01 -0.300698D+01  0.101432D+01 -0.429545D+00
      2  -0.175308D+01  0.464154D+01 -0.507910D+01  0.289686D+01 -0.356284D+01
      3  -0.100577D+01  0.212011D+02 -0.371471D+01 -0.105522D+01 -0.530093D+01
               126           127           128           129           130 
      1   0.547322D+00 -0.264770D+01  0.268885D+01 -0.477696D+00  0.973620D+00
      2   0.175405D+01 -0.299771D+01  0.291898D+01 -0.450768D+01  0.267062D+01
      3   0.234141D+01 -0.500550D+01  0.387408D+01 -0.115432D+01  0.333582D+01
               131           132           133           134           135 
      1  -0.108168D+02  0.346949D+01  0.120691D+00  0.503231D+01 -0.272804D+01
      2  -0.100760D+02  0.906606D+01 -0.188879D+01  0.450103D+01 -0.724636D+01
      3  -0.169692D+02  0.919688D+01  0.620164D+00  0.580737D+01 -0.504031D+01
               136           137           138           139           140 
      1  -0.161588D+01 -0.254850D+01  0.845722D+00 -0.241296D+01 -0.780152D+00
      2   0.112822D+02  0.677978D-01  0.739046D+01  0.182242D+00 -0.776593D+00
      3  -0.546933D+01 -0.579942D+01  0.722856D+00 -0.379797D+01 -0.739500D+00
               141           142           143           144           145 
      1   0.334961D+00 -0.116984D+00  0.131186D+01  0.605367D-01  0.184921D+01
      2  -0.174152D+00  0.158872D+01  0.390180D+00  0.985355D+00 -0.490096D+01
      3   0.243387D+01 -0.864750D+00  0.275580D+01 -0.479373D+00  0.348928D+01
               146           147           148           149           150 
      1   0.302572D+01  0.213370D+00  0.182893D+01  0.584154D+01  0.240330D+01
      2  -0.470479D+01 -0.838675D+01 -0.278549D+01 -0.119376D+02 -0.133439D+02
      3   0.445854D+01  0.318006D+01  0.358175D+01  0.110359D+02  0.101626D+02
               151           152           153           154           155 
      1  -0.226179D+00  0.498762D+01  0.250150D+01  0.461936D+01  0.915435D+00
      2  -0.423684D+01 -0.956245D+01 -0.170969D+02 -0.108996D+02 -0.108343D+01
      3  -0.115142D+00  0.765273D+01  0.884794D+01 -0.888375D+01 -0.220699D+02
               156           157           158           159           160 
      1  -0.592978D+01  0.790222D+01  0.438759D+01 -0.338541D+01 -0.334393D+01
      2   0.206416D+02 -0.343114D+00 -0.450754D+01  0.116852D+02  0.529964D+01
      3  -0.510708D+00 -0.185937D+02 -0.237118D+02  0.385922D+00  0.399878D+01
               161           162           163           164           165 
      1   0.146930D+01  0.137844D+01  0.644845D+01  0.302143D+01 -0.302507D+01
      2   0.336943D+01 -0.827488D+01 -0.141482D+02 -0.523421D+01  0.309022D+01
      3   0.413435D+01 -0.266190D+01 -0.937321D+01 -0.383157D+01  0.584667D+00
               166           167           168           169           170 
      1   0.863674D+01  0.451614D+01  0.221969D+01 -0.138539D+01  0.716781D+01
      2  -0.961427D+01  0.482297D+01  0.857532D+01 -0.242093D+01  0.352831D+01
      3  -0.102139D+01 -0.450502D+01 -0.912183D+01  0.654492D+01 -0.216695D+01
               171           172           173           174           175 
      1  -0.267004D+01 -0.783014D+01 -0.355679D+01  0.473961D+00 -0.967714D+01
      2   0.235286D+02  0.228753D+02  0.396750D+01 -0.769735D+01  0.919903D+01
      3  -0.318753D+01  0.289189D+01  0.241842D+01  0.230709D+01  0.895677D+01
               176           177           178           179           180 
      1  -0.301545D+01 -0.189971D+01  0.627136D-01 -0.171170D+00 -0.723902D+00
      2   0.378703D+01 -0.436520D+01 -0.296778D+01 -0.102867D+01  0.576047D+01
      3   0.871379D+00  0.634396D+00  0.197768D+01  0.773194D+00  0.746193D+00
               181           182           183           184           185 
      1  -0.718608D+00  0.213441D+01  0.439892D+01  0.269025D+01 -0.107800D+01
      2  -0.698189D+01 -0.191622D+01  0.597549D+01 -0.113177D+01 -0.789219D+01
      3  -0.308594D+02 -0.129351D+02  0.297965D+01 -0.121346D+02 -0.277787D+02
               186           187           188           189           190 
      1  -0.234673D+01  0.159696D+02  0.402089D+01 -0.254791D+01 -0.100229D+01
      2  -0.860684D+00 -0.229701D+01 -0.109023D+02  0.106062D+01 -0.402444D+01
      3   0.616732D+01  0.354237D+01  0.769178D+01 -0.297253D+01  0.110910D+02
               191           192           193           194           195 
      1   0.331526D+01 -0.443840D+00  0.338284D+01  0.216623D+01  0.275359D+01
      2   0.412773D+01 -0.216710D+01  0.137435D+02  0.156057D+01 -0.272714D+01
      3   0.213470D+02 -0.404262D+01  0.532286D+02  0.179164D+02 -0.571169D+01
               196           197           198           199           200 
      1  -0.421429D+01  0.147542D+02 -0.312920D+01  0.235704D+00 -0.205708D+01
      2  -0.166010D+01 -0.503437D+01  0.115093D+01  0.270575D+01 -0.208353D+01
      3  -0.101176D+02 -0.402903D+01  0.603022D+01 -0.209477D+02 -0.121460D+02
               201           202           203           204           205 
      1   0.270430D+00 -0.203572D+01  0.134542D+01 -0.305927D+01 -0.393481D+01
      2   0.419815D+01 -0.862424D+01  0.436223D+01  0.344052D+01 -0.172477D+02
      3   0.237454D+01 -0.400291D+01  0.207708D+00 -0.165208D+01  0.541787D+01
               206           207           208           209           210 
      1   0.393651D+01  0.252242D+00  0.105322D+01 -0.310711D+01  0.725256D+00
      2   0.153934D+02 -0.432183D+01  0.312514D+01 -0.528582D+01  0.130437D+02
      3  -0.371547D+01 -0.673574D+01  0.940035D+01 -0.407853D+02  0.479557D+01
               211           212           213           214           215 
      1   0.258188D+00 -0.938001D+00 -0.575334D+01  0.252402D+01 -0.146989D+01
      2  -0.121434D+01  0.231120D+01  0.637752D+01 -0.562412D+01 -0.380340D+01
      3  -0.241385D+01  0.116441D+02 -0.258225D+01  0.746269D+00  0.179434D+01
               216           217           218           219           220 
      1   0.117885D+01 -0.142808D+01  0.485024D+00 -0.120025D+01  0.304897D+01
      2  -0.744576D+00 -0.683571D+01 -0.126325D+01  0.786763D+01 -0.272975D+01
      3   0.159321D+01 -0.364052D+02 -0.227522D+01  0.376624D+01  0.109316D+02
               221           222           223           224           225 
      1   0.374055D+01  0.545884D+01  0.124384D+02  0.696887D+01 -0.171919D+01
      2  -0.677680D+01 -0.328754D+02 -0.871304D+01 -0.212475D+02  0.160515D+02
      3   0.200707D+02  0.707158D+01  0.363076D+01  0.568202D+01  0.271401D+02
               226           227           228           229           230 
      1   0.215515D+00 -0.300446D+00 -0.193534D+01  0.937467D-02 -0.813242D+00
      2   0.191483D+01  0.185832D+01 -0.532586D-01  0.138417D+01  0.372435D+01
      3   0.904330D+01  0.804446D+01 -0.206996D+01  0.666935D+01  0.184524D+02
               231           232           233           234           235 
      1  -0.406887D+01  0.124855D+01  0.199634D+01  0.362466D+00 -0.787573D+00
      2  -0.593131D+00 -0.149273D+00 -0.117367D+01  0.139106D-01 -0.864907D+00
      3  -0.373612D+01 -0.207187D+01 -0.394748D+01  0.285994D+00 -0.116923D+00
               236           237           238           239           240 
      1   0.839744D+00  0.212864D+01 -0.163930D+00 -0.903045D+00 -0.363641D+01
      2   0.306589D-01  0.247763D+01 -0.100291D+01  0.116601D+01 -0.386489D+01
      3  -0.566576D+01  0.573204D+00 -0.610035D+01  0.165886D+02 -0.136741D+01
               241           242           243           244           245 
      1  -0.273647D+01  0.114574D+01  0.577831D+00  0.294003D+00 -0.520166D-01
      2  -0.208290D+01 -0.133261D+01  0.126371D+01 -0.653997D+00 -0.842498D+00
      3   0.188037D+01 -0.214082D+01  0.197486D+01 -0.438025D+00 -0.266026D+01
               246           247           248           249           250 
      1  -0.109551D+01  0.203197D+00 -0.281533D+00 -0.264435D+01 -0.366393D+00
      2   0.103079D+01 -0.999770D+00 -0.279156D+01  0.281582D+01 -0.112581D+01
      3   0.447560D+00 -0.117866D+01 -0.132773D+02  0.234483D+01  0.558668D+00
               251           252           253           254           255 
      1   0.132621D+01  0.365970D+00 -0.441382D+00  0.618726D+00  0.148647D+01
      2  -0.786372D+00 -0.123393D+00 -0.548599D+01  0.958531D+00 -0.566152D+01
      3   0.280489D+01  0.496603D-01  0.125296D+01  0.327319D+01 -0.257405D+01
               256           257           258           259           260 
      1  -0.219363D+00 -0.199302D+00 -0.207247D+01 -0.268875D+01  0.137807D+01
      2  -0.443707D+01 -0.836653D+01  0.141439D+02  0.102512D+02  0.129266D+02
      3  -0.539821D+01 -0.127205D+02  0.103629D+02  0.564005D+01  0.111823D+02
               261           262           263           264           265 
      1   0.529495D+01  0.707770D+00 -0.563238D+00 -0.344557D+00 -0.585123D+00
      2  -0.357965D+02  0.117562D+01  0.626102D-01  0.863998D+01  0.434496D+00
      3  -0.175692D+02  0.155777D+02 -0.994480D+01 -0.907992D+00 -0.834041D+01
               266           267           268           269           270 
      1   0.127090D+00 -0.762783D+00 -0.133063D+01  0.944712D-01  0.177175D+00
      2   0.837531D+00 -0.104527D+01  0.727136D+01  0.888893D+00 -0.164067D+01
      3   0.563766D+01 -0.495088D+00 -0.926197D+00 -0.777305D+00 -0.997153D+00
               271           272           273           274           275 
      1   0.110532D+00  0.156476D+00  0.924868D+00 -0.183803D+01 -0.289771D+01
      2   0.644028D+01  0.706897D+00 -0.247177D+01  0.621215D+01  0.112399D+02
      3  -0.177032D+01  0.192028D+01  0.330471D+00 -0.116757D+02 -0.259228D+02
               276           277           278           279 
      1  -0.466598D+01 -0.367386D+01 -0.151974D+01 -0.542457D+01
      2   0.143521D+02  0.712835D+01  0.131852D+02  0.175638D+02
      3  -0.137989D+02 -0.791244D+01 -0.161031D+02 -0.160852D+02
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.761695D+02  0.367448D+02 -0.279563D+01 -0.706559D+02  0.447208D+01
      2   0.369437D+02 -0.234615D+02  0.211127D+01  0.365056D+02  0.467873D+01
      3   0.392259D+02 -0.132833D+02  0.684366D+00  0.341503D+02 -0.915081D+01
      4   0.180146D+02  0.922352D+01 -0.227167D+01  0.114228D+02 -0.196918D+02
      5  -0.583781D+01 -0.278261D+01  0.877648D+00 -0.547338D+01  0.629938D+01
      6   0.400407D+01  0.252172D+00  0.112907D+01  0.386033D+01 -0.504972D+01
                 6             7             8             9            10 
      1   0.208621D+01  0.179069D+02 -0.493123D+01 -0.972590D+01  0.115911D+03
      2  -0.376449D+01 -0.774142D+01  0.156553D+01 -0.121566D+01 -0.539917D+02
      3   0.167828D+01 -0.101654D+02  0.336570D+01  0.109416D+02 -0.619188D+02
      4   0.343873D+01 -0.315453D+01  0.303374D+01 -0.442230D+00  0.421274D+01
      5   0.252616D+01  0.899068D+00 -0.585772D+00  0.174399D+00  0.277182D+00
      6   0.375216D+00  0.192814D+01  0.341652D+01  0.145403D+01 -0.776396D+01
                11            12            13            14            15 
      1  -0.677980D+01 -0.736312D+01  0.532044D+02 -0.283855D+02  0.130973D+01
      2   0.136746D+01  0.320592D+01 -0.176510D+02  0.197167D+02 -0.354835D+01
      3   0.541234D+01  0.415720D+01 -0.355534D+02  0.866885D+01  0.223862D+01
      4   0.133919D+02 -0.458376D+01 -0.259643D+02  0.172513D+02 -0.113462D+01
      5  -0.657809D+01 -0.849834D+01  0.894659D+01 -0.277787D+01 -0.108851D-01
      6   0.332464D+01  0.864820D+00 -0.423989D+01 -0.272685D+00 -0.679590D+00
                16            17            18            19            20 
      1  -0.176533D+02  0.503766D+01 -0.429672D+01  0.446168D+02 -0.430808D+02
      2   0.721890D+01 -0.356271D+01 -0.327041D+01 -0.199562D+02  0.306307D+02
      3   0.104344D+02 -0.147495D+01  0.756713D+01 -0.246606D+02  0.124500D+02
      4   0.572631D+01 -0.297563D+01  0.384055D+01 -0.224533D+02 -0.114369D+02
      5   0.155820D+01  0.309208D+01  0.102165D+01  0.846036D+01  0.339654D+01
      6   0.481217D+01  0.313094D+01  0.186445D+01 -0.401113D+01  0.392886D+00
                21            22            23            24            25 
      1   0.448116D+01  0.353808D+01  0.336664D+02 -0.490684D+01 -0.468842D+01
      2  -0.348830D+01 -0.206275D+02 -0.323300D+02  0.618625D+01  0.758179D+01
      3  -0.992862D+00  0.170894D+02 -0.133632D+01 -0.127941D+01 -0.289338D+01
      4   0.239640D+01  0.161559D+02 -0.271539D+01  0.343283D+01 -0.201362D+01
      5  -0.377996D+01 -0.624439D+01  0.372218D+01  0.796356D+01  0.454760D+01
      6   0.751684D+00  0.106656D+02  0.536341D+01  0.160054D+01  0.295889D+01
                26            27            28            29            30 
      1  -0.205091D+01 -0.778017D+01  0.102492D+02  0.262019D+00  0.382472D+01
      2   0.572071D+01 -0.655842D+01 -0.275747D+02 -0.283556D+01 -0.144802D+01
      3  -0.366980D+01  0.143386D+02  0.173254D+02  0.257355D+01 -0.237670D+01
      4   0.524366D+01  0.430722D+01  0.155082D+01  0.141538D+02  0.894681D+00
      5   0.922595D+01 -0.238756D+01 -0.126201D+02  0.259546D+01  0.106905D+02
      6   0.430142D+01 -0.533562D+00  0.126164D+02 -0.175129D+01 -0.246288D+01
                31            32            33            34            35 
      1   0.213674D+02 -0.626141D+02  0.720789D+01 -0.466828D+01  0.101078D+02
      2  -0.773560D+01  0.577728D+02 -0.112358D+02  0.132958D+00 -0.109186D+02
      3  -0.136319D+02  0.484125D+01  0.402794D+01  0.453532D+01  0.810835D+00
      4  -0.372146D+02 -0.109130D+02  0.417171D+01  0.147125D+02  0.319597D+01
      5   0.110259D+02  0.471121D+01 -0.138777D+01  0.338644D+02 -0.610525D+01
      6  -0.190978D+01 -0.515624D+01 -0.186615D+01 -0.704732D+01  0.595440D+01
                36            37            38            39            40 
      1  -0.254009D+00 -0.529482D+01  0.660345D+02 -0.128594D+02 -0.210686D+02
      2  -0.868193D+01  0.370283D+00 -0.507651D+02  0.779234D+01  0.243543D+02
      3   0.893594D+01  0.492454D+01 -0.152694D+02  0.506709D+01 -0.328568D+01
      4  -0.529040D+00  0.201955D+02 -0.147662D+02 -0.137308D+00  0.163157D+02
      5  -0.339001D+00 -0.330363D+01 -0.335123D+01  0.129827D+01  0.366784D+01
      6   0.546800D+01 -0.394418D+01  0.375601D+01 -0.871762D+01 -0.113317D+02
                41            42            43            44            45 
      1   0.235958D+02 -0.762663D+01  0.658091D+01 -0.135201D+02 -0.132519D+02
      2  -0.278755D+02  0.727257D+01 -0.105174D+02  0.150870D+02  0.378734D+01
      3   0.427975D+01  0.354063D+00  0.393651D+01 -0.156695D+01  0.946453D+01
      4   0.169294D+02 -0.757257D+01  0.603057D+00 -0.551070D+01 -0.714407D+01
      5  -0.878080D+01 -0.728411D+01  0.191320D+02 -0.834244D+01  0.421730D+01
      6   0.861539D+01  0.513949D+01 -0.190684D+02  0.169394D+02  0.291467D+00
                46            47            48            49            50 
      1   0.157437D+01 -0.513721D+02  0.768191D+01  0.297332D+02  0.379509D+01
      2  -0.247346D+01  0.402466D+02 -0.328871D+01 -0.257433D+02 -0.996708D+01
      3   0.899093D+00  0.111255D+02 -0.439320D+01 -0.398986D+01  0.617199D+01
      4  -0.152486D+02 -0.730325D+01  0.383634D+01  0.943998D+01 -0.120157D+02
      5   0.487858D+01  0.574937D+01  0.593887D+00 -0.234918D+01  0.254114D+01
      6   0.406978D+01  0.775224D+00  0.791666D+01  0.342148D+01  0.102106D+02
                51            52            53            54            55 
      1  -0.693757D+01 -0.540364D+01 -0.167147D+01 -0.214252D+02 -0.213836D+02
      2   0.772559D+01  0.689941D+01  0.871913D+01  0.959421D+01  0.796177D+01
      3  -0.788015D+00 -0.149577D+01 -0.704766D+01  0.118310D+02  0.134218D+02
      4   0.370943D+01  0.175322D+01  0.665262D+01  0.673655D+01  0.562889D+01
      5   0.840646D+00  0.461340D+01  0.308333D+01 -0.453944D+00 -0.265740D+01
      6   0.384868D+01  0.454078D+01  0.211353D+02 -0.528179D+01  0.310989D+01
                56            57            58            59            60 
      1  -0.357182D+02  0.586298D+01  0.104167D+02  0.152916D+02 -0.859487D+01
      2   0.313778D+02 -0.207590D+01 -0.119654D+02 -0.160408D+02  0.809926D+01
      3   0.434036D+01 -0.378707D+01  0.154869D+01  0.749265D+00  0.495612D+00
      4  -0.475060D+02  0.753899D+01  0.114529D+02 -0.653256D+01 -0.235016D+00
      5   0.107979D+02 -0.805838D+01 -0.246710D+01 -0.157321D+01 -0.878590D+00
      6  -0.265075D+01  0.828250D+01  0.375532D+01  0.941301D+01  0.269366D+01
                61            62            63            64            65 
      1  -0.198139D+01 -0.558901D+01 -0.269724D+02  0.327679D+01 -0.112797D+01
      2   0.532007D+01  0.116562D+02  0.984169D+01 -0.437249D+00  0.235691D+01
      3  -0.333868D+01 -0.606723D+01  0.171307D+02 -0.283954D+01 -0.122894D+01
      4  -0.278436D+01  0.354778D+01 -0.521199D+01  0.975129D+01  0.101137D+02
      5  -0.236170D+01 -0.987270D+01  0.621576D+01 -0.292939D+01 -0.222473D+01
      6   0.578919D+01  0.190224D+02 -0.635087D+01 -0.185153D+01 -0.152157D+01
                66            67            68            69            70 
      1   0.267408D+00 -0.407922D+01 -0.144994D+02  0.333587D+01  0.797521D-02
      2   0.241181D+00  0.628054D+01  0.172398D+02 -0.161999D+01  0.125014D+00
      3  -0.508589D+00 -0.220132D+01 -0.274043D+01 -0.171588D+01 -0.132989D+00
      4  -0.171604D+01  0.137352D+02  0.182756D+02 -0.333458D+01 -0.293269D+01
      5   0.282709D+01 -0.351710D+01 -0.351343D+01  0.351331D+01  0.150215D+01
      6   0.147153D+01 -0.318426D+01 -0.609224D+01  0.492043D+01  0.206919D+01
                71            72            73            74            75 
      1   0.200814D+01 -0.268090D+01 -0.108783D+01  0.707882D+01 -0.875969D+00
      2  -0.187502D+01  0.244306D+01  0.105613D+02 -0.162137D+02  0.147586D+01
      3  -0.133120D+00  0.237841D+00 -0.947349D+01  0.913491D+01 -0.599894D+00
      4  -0.352448D+01  0.228949D+01 -0.224244D+02  0.224301D+02 -0.238757D+01
      5   0.714619D+00 -0.135990D+01  0.188502D+01 -0.244525D+01  0.290446D+01
      6   0.292810D+01 -0.201952D+01 -0.113303D+01  0.154833D+01 -0.267977D+01
                76            77            78            79            80 
      1   0.124497D+02 -0.298379D+02  0.354691D+01 -0.238019D+01  0.441103D+01
      2  -0.236834D+02  0.479342D+02 -0.443456D+01  0.422500D+01 -0.636569D+01
      3   0.112337D+02 -0.180963D+02  0.887652D+00 -0.184481D+01  0.195466D+01
      4   0.244889D+02 -0.338789D+02  0.375037D+01 -0.326238D+01  0.415276D+01
      5  -0.327756D+01  0.422805D+01 -0.346602D+01  0.268938D+00 -0.206282D+01
      6   0.374464D+01 -0.533201D+01  0.655191D+01  0.116069D+01  0.319428D+01
                81            82            83            84            85 
      1  -0.158502D+01 -0.622240D+01 -0.105774D+02  0.243748D+01 -0.968523D+01
      2   0.270800D+01  0.102504D+02  0.171383D+02 -0.275085D+01  0.139132D+02
      3  -0.112298D+01 -0.402798D+01 -0.656092D+01  0.313366D+00 -0.422793D+01
      4  -0.274499D+01  0.115979D+02  0.194722D+02 -0.340579D+01  0.121972D+02
      5   0.108930D+01 -0.133901D+01 -0.196657D+01  0.288119D+01 -0.138818D+01
      6  -0.190229D+01 -0.255164D+01 -0.394116D+01  0.334506D+01 -0.289029D+01
                86            87            88            89            90 
      1  -0.415968D+02  0.788021D+01  0.187442D+01  0.841010D+01 -0.262629D+01
      2   0.584488D+02 -0.884786D+01 -0.283108D+01 -0.104422D+02  0.307620D+01
      3  -0.168520D+02  0.967649D+00  0.956660D+00  0.203209D+01 -0.449912D+00
      4   0.274772D+02 -0.451570D+01 -0.320514D+01 -0.508738D+01  0.323012D+01
      5  -0.199190D+01  0.215149D+01  0.816542D+00  0.285957D+01 -0.143066D+01
      6  -0.109819D+02  0.852175D+01  0.981455D+00  0.521330D+01 -0.289279D+01
                91            92            93            94            95 
      1  -0.770304D+01  0.181260D+01 -0.145638D+02 -0.663108D+01 -0.154224D+01
      2   0.139491D+02  0.235653D+01  0.123910D+01  0.129253D+02 -0.115331D+02
      3  -0.624607D+01 -0.416913D+01  0.133247D+02 -0.629423D+01  0.130753D+02
      4  -0.576887D+01 -0.144563D+02 -0.383742D+01 -0.165371D+02  0.379004D+02
      5  -0.971264D+00 -0.465245D+01 -0.214245D+02  0.164686D+01 -0.132652D+02
      6  -0.541305D+01  0.171070D+01  0.110590D+01 -0.430802D+01  0.335724D+01
                96            97            98            99           100 
      1  -0.216973D+01 -0.265369D+01 -0.420121D+01 -0.213734D+02 -0.789158D+02
      2   0.148271D+01 -0.126378D+02  0.907226D+01  0.204999D+02  0.448949D+02
      3   0.687019D+00  0.152915D+02 -0.487105D+01  0.873530D+00  0.340209D+02
      4  -0.152418D+02 -0.854897D+01 -0.168412D+02 -0.384074D+01  0.124506D+02
      5  -0.539559D+01 -0.647570D+02  0.205274D+01  0.160334D+02  0.427270D+02
      6   0.400201D+01  0.261153D+01 -0.624220D+00 -0.140000D+01 -0.421474D+01
               101           102           103           104           105 
      1   0.810894D+01  0.304984D+02  0.505771D+01  0.303616D+02  0.915166D+01
      2  -0.361700D+01 -0.854434D+01 -0.642214D+01 -0.509969D+01  0.268487D+00
      3  -0.449194D+01 -0.219541D+02  0.136443D+01 -0.252619D+02 -0.942015D+01
      4   0.178126D+02  0.125797D+01  0.166854D+02 -0.148225D+02  0.240592D+02
      5   0.829604D+00  0.103409D+02 -0.140922D+00  0.161360D+02  0.771183D+01
      6  -0.114222D+02 -0.325375D+01 -0.596776D+01  0.374008D+01 -0.199304D+02
               106           107           108           109           110 
      1   0.364981D+01  0.847081D+01  0.208565D+02 -0.802042D+02 -0.258553D+02
      2   0.172173D+02 -0.344585D+01 -0.224418D+02  0.306097D+02  0.468574D+01
      3  -0.208671D+02 -0.502497D+01  0.158529D+01  0.495945D+02  0.211696D+02
      4   0.228156D+01  0.196113D+02  0.442086D+01 -0.439686D+02 -0.257381D+02
      5   0.416690D+02  0.131760D+01 -0.290806D+02  0.189733D+01 -0.195185D+01
      6  -0.385454D+01 -0.141452D+02 -0.748137D+01 -0.909935D+00  0.212697D+01
               111           112           113           114           115 
      1   0.179938D+01 -0.348873D+02 -0.153733D+02  0.895102D+01  0.405900D+02
      2  -0.234875D+01  0.753834D+01  0.567122D+01 -0.638995D+00 -0.196257D+02
      3   0.549378D+00  0.273490D+02  0.970209D+01 -0.831203D+01 -0.209643D+02
      4   0.854086D+00 -0.117331D+02 -0.235159D+02  0.849233D+01  0.187510D+02
      5  -0.194186D+01 -0.324658D+01  0.606066D+01 -0.545072D+01  0.268021D+02
      6  -0.407821D+01  0.347119D+01 -0.373108D+01  0.176786D+00  0.485272D+01
               116           117           118           119           120 
      1   0.757821D+01  0.259668D+02  0.737753D+01 -0.949007D+01  0.490571D+01
      2  -0.305176D+01 -0.380283D+01  0.310565D+01  0.120395D+00 -0.125484D+01
      3  -0.452644D+01 -0.221640D+02 -0.104832D+02  0.936968D+01 -0.365087D+01
      4   0.151615D+02  0.617617D+01 -0.211418D+02  0.212021D+02 -0.920858D+00
      5   0.364565D+01  0.165478D+01  0.563427D+01 -0.519565D+00  0.100368D+02
      6  -0.112396D+01 -0.891047D+00 -0.158378D+01  0.645975D+00 -0.850685D+00
               121           122           123           124           125 
      1  -0.165727D+02 -0.207544D+01 -0.639615D+00  0.656068D+01  0.159831D+01
      2   0.260719D+01  0.199238D+02 -0.301374D+01 -0.226717D+01 -0.481981D+01
      3   0.139655D+02 -0.178483D+02  0.365335D+01 -0.429351D+01  0.322149D+01
      4   0.234055D+02 -0.497927D+02  0.772246D+01 -0.311732D+01  0.116898D+02
      5  -0.203933D+01  0.698797D+01 -0.103542D+02  0.120439D+02 -0.818495D+01
      6   0.639077D+00 -0.264174D+01  0.427061D+01 -0.262777D+01  0.631184D+01
               126           127           128           129           130 
      1   0.257512D+01  0.874627D+00  0.642854D+01 -0.887910D+01  0.986927D+01
      2  -0.642521D+00 -0.439792D+00 -0.283549D+01  0.138581D+00 -0.666227D+01
      3  -0.193260D+01 -0.434835D+00 -0.359304D+01  0.874052D+01 -0.320700D+01
      4  -0.878420D+01  0.360679D+01 -0.468457D+01  0.147952D+01  0.151834D+01
      5   0.343649D+01 -0.148420D+01 -0.100432D+01 -0.444407D+01 -0.945081D+01
      6  -0.249561D+01 -0.311279D+01  0.458733D+01 -0.168979D+01  0.177647D+00
               131           132           133           134           135 
      1  -0.159923D+02  0.873409D+01 -0.328865D+01  0.542115D+01 -0.116755D+02
      2   0.579721D+01  0.354912D+01  0.850407D+00  0.168237D+01 -0.131550D+01
      3   0.101950D+02 -0.122832D+02  0.243824D+01 -0.710352D+01  0.129910D+02
      4   0.286427D+02 -0.157944D+02 -0.103248D+01 -0.104792D+02  0.853575D+01
      5  -0.119014D+02  0.166958D+02  0.162680D+01  0.682876D+01 -0.908876D+01
      6  -0.195413D+02  0.134310D+02  0.628823D+00  0.106996D+02 -0.710311D+01
               136           137           138           139           140 
      1   0.115039D+03 -0.608314D+01 -0.208082D+02 -0.446553D+01  0.660422D+01
      2  -0.694247D+02  0.284067D+01  0.190706D+02  0.125762D+01 -0.439094D+01
      3  -0.456140D+02  0.324247D+01  0.173768D+01  0.320792D+01 -0.221328D+01
      4  -0.135413D+02  0.116927D+02  0.377129D+01  0.152614D+02 -0.133259D+01
      5  -0.662438D+02  0.427138D+01  0.302228D+02  0.258516D+01 -0.726192D+01
      6   0.569122D+01 -0.408786D+01 -0.231873D+01 -0.482757D+01  0.274605D+00
               141           142           143           144           145 
      1  -0.153433D+00 -0.770573D+01 -0.131089D+01  0.863231D+01 -0.102583D+01
      2  -0.115963D+00  0.841142D+01  0.315910D-01 -0.701612D+01 -0.926708D+00
      3   0.269396D+00 -0.705695D+00  0.127930D+01 -0.161618D+01  0.195254D+01
      4  -0.592103D+01 -0.252275D-01 -0.328035D+01 -0.111952D+01 -0.368554D+01
      5  -0.108804D+01  0.172971D+02 -0.418185D+00 -0.746299D+01 -0.320897D+01
      6   0.437940D+01 -0.668246D+00  0.257823D+01  0.111259D+01  0.451280D+01
               146           147           148           149           150 
      1  -0.104458D+02 -0.161082D+02 -0.847812D+01 -0.198102D+02 -0.174003D+02
      2   0.380281D+01  0.162263D+01  0.554564D+01  0.808410D+01  0.174938D+00
      3   0.664295D+01  0.144856D+02  0.293248D+01  0.117261D+02  0.172254D+02
      4  -0.492441D+01 -0.307579D+01  0.234691D+01 -0.192219D+02 -0.186609D+02
      5  -0.660246D+00 -0.622383D+01  0.741504D+01 -0.146901D+02 -0.208114D+02
      6   0.695520D+01  0.640302D+01  0.158613D+00  0.187628D+02  0.198142D+02
               151           152           153           154           155 
      1  -0.572637D+01 -0.129651D+02 -0.253688D+02  0.169567D+03  0.362776D+02
      2   0.211442D+01 -0.196878D+00 -0.332185D+01 -0.753020D+02 -0.105265D+02
      3   0.361194D+01  0.131620D+02  0.286906D+02 -0.942647D+02 -0.257511D+02
      4   0.202027D+01 -0.134958D+02 -0.147817D+02  0.624714D+02  0.441228D+02
      5   0.380383D+01 -0.128211D+02 -0.231005D+02  0.123696D+02  0.525689D+01
      6   0.443997D+00  0.151815D+02  0.181647D+02  0.252286D+00  0.917484D+00
               156           157           158           159           160 
      1  -0.467458D+01  0.499159D+02  0.341616D+02 -0.383146D+01 -0.823516D+01
      2  -0.157107D+01 -0.114689D+02 -0.247614D+01 -0.813524D+00  0.230765D+00
      3   0.624564D+01 -0.384469D+02 -0.316854D+02  0.464499D+01  0.800440D+01
      4   0.168568D+01  0.629361D+02  0.517126D+02 -0.460511D+01 -0.612332D+01
      5   0.321530D+02  0.237532D+01  0.221009D+00  0.152565D+02  0.295899D+02
      6   0.564519D+01  0.384537D+01  0.339453D+01  0.662295D+01  0.664347D+01
               161           162           163           164           165 
      1  -0.383647D+01  0.168254D+02  0.499383D+02  0.147988D+02  0.108499D+02
      2  -0.534236D+00 -0.983165D+01 -0.324523D+02 -0.570569D+01 -0.917502D+01
      3   0.437071D+01 -0.699374D+01 -0.174860D+02 -0.909312D+01 -0.167489D+01
      4  -0.923596D+01  0.108747D+02  0.270246D+02  0.115148D+02  0.204903D+01
      5   0.997233D+01 -0.755940D+01  0.293589D+02  0.340831D+01  0.188849D+02
      6   0.537682D+01 -0.540632D+00  0.107142D+02  0.174453D+01  0.748848D+00
               166           167           168           169           170 
      1   0.206649D+02 -0.521039D+01 -0.921734D+01 -0.122362D+02 -0.716604D+01
      2  -0.107686D+02  0.256456D+01  0.156439D+01  0.130384D+01  0.201684D+01
      3  -0.989638D+01  0.264583D+01  0.765295D+01  0.109324D+02  0.514920D+01
      4   0.134201D+02  0.759591D+01  0.113677D+02 -0.606528D+01  0.194247D+01
      5   0.122765D+02  0.121974D+02  0.115889D+02  0.145328D+02  0.388387D+01
      6   0.329999D+01  0.686238D+01  0.124522D+02 -0.531299D+00  0.990438D+01
               171           172           173           174           175 
      1  -0.301958D+02 -0.462806D+02 -0.887899D+01  0.101027D+02 -0.207120D+02
      2  -0.151183D+02  0.259356D+02  0.408218D+01  0.406430D+01  0.137824D+02
      3   0.453141D+02  0.203450D+02  0.479681D+01 -0.141670D+02  0.692964D+01
      4   0.192374D+01 -0.212021D+02 -0.802880D+01 -0.187925D+01 -0.110080D+02
      5   0.454408D+02 -0.216571D+02 -0.471241D+01 -0.150802D+02 -0.122841D+02
      6   0.796022D+01 -0.808746D+01 -0.433382D+01 -0.271038D+01 -0.401174D+01
               176           177           178           179           180 
      1  -0.899821D+01  0.276087D+01 -0.192089D+01  0.574379D+00 -0.115854D+02
      2   0.466294D+01  0.330796D+01  0.758523D+01  0.664487D+00  0.306252D+01
      3   0.433527D+01 -0.606883D+01 -0.566434D+01 -0.123887D+01  0.852292D+01
      4  -0.427335D+01  0.161680D+01 -0.517254D+01 -0.225747D+00 -0.373057D+01
      5   0.597503D+00 -0.908423D+01 -0.841873D+01 -0.164684D+01  0.130019D+01
      6  -0.243762D+01  0.224247D+01 -0.249985D+01  0.150240D+01 -0.211197D+01
               181           182           183           184           185 
      1   0.381547D+02  0.497311D+02 -0.111299D+02 -0.395706D+02  0.188962D+02
      2  -0.246055D+02 -0.380632D+02  0.528748D+01  0.264821D+02 -0.214339D+02
      3  -0.135492D+02 -0.116679D+02  0.584247D+01  0.130884D+02  0.253766D+01
      4   0.107987D+02  0.282739D+02 -0.648153D+01  0.116842D+02  0.252165D+02
      5   0.434814D+00 -0.920150D+01  0.119465D+02  0.312580D+01 -0.102117D+02
      6  -0.167058D+01  0.741039D+01 -0.904148D+01 -0.680218D+01  0.850482D+01
               186           187           188           189           190 
      1  -0.181841D+01  0.733133D+01 -0.903337D+01  0.118134D+01  0.969921D+02
      2   0.391653D+01 -0.132613D+02  0.137020D+02 -0.435650D+01 -0.528664D+02
      3  -0.209812D+01  0.592997D+01 -0.466860D+01  0.317515D+01 -0.441257D+02
      4  -0.105973D+02 -0.861357D+00 -0.134474D+02 -0.203028D+02 -0.125529D+02
      5  -0.455895D+01  0.291217D+02 -0.188390D+02  0.782926D+01  0.611653D+01
      6   0.376020D+01 -0.220781D+02  0.161366D+02 -0.495314D+00 -0.605626D+00
               191           192           193           194           195 
      1  -0.222590D+02 -0.614685D+00 -0.860578D+02 -0.334013D+02  0.156162D+02
      2   0.672304D+01 -0.653219D+00  0.462279D+02  0.381225D+02 -0.152604D+02
      3   0.155359D+02  0.126790D+01  0.398299D+02 -0.472119D+01 -0.355778D+00
      4   0.119585D+02 -0.201878D+01 -0.349258D+02 -0.519171D+02  0.989214D+01
      5  -0.223422D+01  0.774595D-01  0.171463D+02  0.879017D+01 -0.653517D+01
      6   0.289370D+01 -0.182903D+01  0.210155D+01 -0.104696D+02 -0.180658D+01
               196           197           198           199           200 
      1   0.154490D+02  0.106016D+02  0.205369D+02 -0.116406D+03 -0.202193D+01
      2  -0.942574D+01 -0.938151D+01 -0.184822D+02  0.547788D+02  0.852371D+01
      3  -0.602322D+01 -0.122010D+01 -0.205467D+01  0.616273D+02 -0.650178D+01
      4   0.152404D+02  0.548187D+01 -0.802899D+01 -0.760248D+01 -0.228220D+02
      5   0.450757D+02 -0.138321D+02  0.201582D+01  0.321687D+01  0.960964D+01
      6  -0.486390D+01  0.622695D+01  0.318751D+01  0.749770D+01 -0.414926D+01
               201           202           203           204           205 
      1   0.757372D+01  0.113080D+03  0.618362D+01 -0.956708D+01 -0.127970D+02
      2  -0.484173D+01 -0.696933D+02 -0.158232D+02  0.841746D+01  0.102045D+02
      3  -0.273199D+01 -0.433870D+02  0.963954D+01  0.114962D+01  0.259249D+01
      4   0.784631D+01  0.142061D+02  0.199694D+02  0.118676D+01  0.556186D+00
      5   0.521149D+01 -0.361974D+01  0.190400D+01  0.958181D+01  0.605401D+01
      6   0.160248D+01  0.321424D+01  0.924753D+01  0.436761D+01  0.338433D+01
               206           207           208           209           210 
      1  -0.893358D+00 -0.110081D+02  0.326537D+02 -0.664935D+01  0.184063D+01
      2   0.397729D+01 -0.504306D+01 -0.185857D+02  0.340519D+01  0.996994D+00
      3  -0.308393D+01  0.160512D+02 -0.140680D+02  0.324416D+01 -0.283763D+01
      4   0.655689D+01  0.186773D+02 -0.191784D+02  0.115132D+02  0.316543D+01
      5   0.220689D+02 -0.866361D+01  0.980277D+00  0.257259D+01  0.235590D+02
      6   0.746101D+01  0.601913D+00  0.196646D+01 -0.102723D+01  0.899360D+00
               211           212           213           214           215 
      1  -0.576780D+01  0.450154D+01  0.161805D+01  0.876758D+00 -0.684972D+00
      2   0.634483D+00  0.953504D-01  0.283902D+01 -0.206070D+00  0.137425D+01
      3   0.513331D+01 -0.459689D+01 -0.445706D+01 -0.670689D+00 -0.689275D+00
      4   0.344860D+02 -0.218424D+02  0.345363D+01 -0.336133D+01  0.945972D+00
      5  -0.208073D+01  0.513859D+01  0.118007D+02  0.128733D+02 -0.787029D+01
      6  -0.856654D+00  0.286591D+01  0.880528D+01 -0.277876D+01  0.435407D+01
               216           217           218           219           220 
      1   0.260952D+01 -0.742988D+02  0.244449D+02  0.261709D+01  0.274064D+02
      2  -0.250332D+01  0.412175D+02 -0.121937D+02 -0.697579D+00 -0.125929D+02
      3  -0.106206D+00  0.330813D+02 -0.122512D+02 -0.191951D+01 -0.148135D+02
      4  -0.803313D+01  0.308019D+02  0.185575D+02 -0.694445D+01 -0.173555D+02
      5  -0.214512D+01  0.114690D+01 -0.672631D+01  0.100027D+02 -0.709035D+01
      6  -0.196224D+01 -0.360827D+01 -0.111996D+01  0.261670D+01 -0.353370D+01
               221           222           223           224           225 
      1   0.469761D+01 -0.867291D+01 -0.952814D+00 -0.559267D+01  0.136389D+02
      2  -0.449990D+01 -0.497355D+01 -0.483910D+01 -0.335340D+01 -0.481262D+01
      3  -0.197710D+00  0.136465D+02  0.579191D+01  0.894607D+01 -0.882626D+01
      4  -0.107776D+02 -0.191283D+02 -0.618718D+01 -0.163551D+02 -0.391178D+02
      5  -0.197008D+02 -0.632476D+02 -0.155172D+02 -0.375835D+02  0.262193D+02
      6  -0.476137D+01 -0.161384D+02 -0.995341D+01 -0.109968D+02  0.798237D+01
               226           227           228           229           230 
      1  -0.898045D+01 -0.184709D+02  0.423962D+01 -0.101859D+02 -0.482944D+02
      2   0.954755D+01  0.197602D+02 -0.321813D+01  0.112931D+02  0.573682D+02
      3  -0.567102D+00 -0.128925D+01 -0.102149D+01 -0.110725D+01 -0.907384D+01
      4   0.405578D+01  0.688800D+01 -0.112403D+01  0.295583D+01 -0.392245D+01
      5  -0.451429D+00 -0.669056D+00  0.113078D+01  0.890817D-01  0.220719D+01
      6  -0.275685D+01 -0.500940D+01  0.351310D+01 -0.289843D+01 -0.137817D+02
               231           232           233           234           235 
      1   0.962155D+01  0.257557D+01  0.100113D+02 -0.278811D+01  0.178969D+02
      2  -0.864639D+01 -0.279137D+01 -0.102773D+02  0.288491D+01  0.185778D+01
      3  -0.975159D+00  0.215799D+00  0.266032D+00 -0.968059D-01 -0.197546D+02
      4   0.101657D+01 -0.381696D+00  0.695501D+00  0.100082D+01 -0.391595D+02
      5  -0.147708D+01  0.208290D+01  0.259017D-01 -0.217172D+00  0.640001D+01
      6   0.888730D+01  0.221796D+00  0.580447D+01 -0.294702D+01 -0.290530D+01
               236           237           238           239           240 
      1  -0.105007D+02  0.116454D+01 -0.740913D+01 -0.429810D+01  0.377754D+00
      2  -0.722592D+01  0.646762D-01 -0.142576D+02  0.321002D+02 -0.206143D+01
      3   0.177266D+02 -0.122922D+01  0.216667D+02 -0.278021D+02  0.168367D+01
      4   0.384722D+02 -0.401830D+01  0.453457D+02 -0.626948D+02  0.710724D+01
      5  -0.559762D+01  0.543713D+01 -0.806750D+01  0.975664D+01 -0.746952D+01
      6   0.306632D+01 -0.352461D+01  0.616986D+01 -0.804057D+01  0.706404D+01
               241           242           243           244           245 
      1  -0.126715D-01  0.929967D+00 -0.163136D+01  0.181822D+02  0.115665D+02
      2   0.304536D+01 -0.366307D+01  0.240073D+01 -0.712677D+01 -0.366608D+01
      3  -0.303269D+01  0.273311D+01 -0.769375D+00 -0.110554D+02 -0.790039D+01
      4  -0.574087D+01  0.774665D+01 -0.461162D+01  0.209492D+02  0.154635D+02
      5   0.871037D+00 -0.401748D+01  0.209023D+01 -0.464749D+01 -0.300632D+01
      6  -0.174766D+00  0.427189D+01 -0.207732D+01 -0.115377D+01 -0.112980D+01
               246           247           248           249           250 
      1  -0.322093D+01  0.139619D+02 -0.533373D+00 -0.665208D+00 -0.383760D+01
      2   0.154579D+01 -0.955261D+00  0.116849D+02 -0.490957D+00  0.147776D+01
      3   0.167515D+01 -0.130066D+02 -0.111515D+02  0.115616D+01  0.235985D+01
      4  -0.368587D+01  0.264336D+02  0.364693D+02 -0.719261D+01 -0.597049D+01
      5   0.273900D+01 -0.502751D+01 -0.576171D+01  0.532077D+01  0.189878D+01
      6   0.113805D+01 -0.247160D+01 -0.409433D+01  0.435877D+01  0.226035D+01
               251           252           253           254           255 
      1  -0.101312D+01 -0.890354D+00 -0.368650D+01 -0.688247D-01 -0.112872D+02
      2  -0.103613D+01  0.168830D+01  0.119856D+01 -0.303212D+00  0.319647D+01
      3   0.204925D+01 -0.797946D+00  0.248794D+01  0.372036D+00  0.809070D+01
      4  -0.754606D+01  0.223499D+01 -0.411889D+01 -0.297199D+01 -0.247866D+00
      5   0.674158D+00 -0.106946D+01 -0.627328D+01  0.192638D+00 -0.722708D+01
      6   0.199988D+01 -0.172184D+01 -0.104897D+01  0.983193D+00 -0.291168D+01
               256           257           258           259           260 
      1   0.512724D+01  0.107845D+01  0.507968D+00 -0.309473D+02 -0.309525D+01
      2  -0.295845D+01  0.169712D+00  0.942052D+00  0.215473D+02  0.336444D+01
      3  -0.216879D+01 -0.124816D+01 -0.145002D+01  0.939994D+01 -0.269189D+00
      4   0.172085D+02  0.174999D+02 -0.167815D+02 -0.182592D+02 -0.164037D+02
      5  -0.117969D+02 -0.153192D+02  0.271762D+02  0.351026D+02  0.231567D+02
      6  -0.437656D+01 -0.666449D+01  0.114299D+02  0.932549D+01  0.981183D+01
               261           262           263           264           265 
      1  -0.226969D+01  0.205318D+03 -0.153764D+02 -0.810964D+01 -0.419091D+02
      2  -0.128258D+02 -0.108055D+03  0.887577D+01  0.513627D+01  0.229967D+02
      3   0.150955D+02 -0.972627D+02  0.650058D+01  0.297337D+01  0.189124D+02
      4   0.254845D+02 -0.608099D+01  0.149674D+02  0.955212D+00  0.201164D+02
      5  -0.663279D+02 -0.119320D+02  0.157940D+01  0.170780D+02  0.335480D+01
      6  -0.161765D+02  0.190821D+01 -0.836026D+00  0.577241D+00 -0.137150D+01
               266           267           268           269           270 
      1   0.184644D+02  0.203096D+01 -0.295696D+01  0.641821D+00  0.151731D+02
      2  -0.908221D+01 -0.934429D+00  0.261059D+01  0.131855D+00 -0.917245D+01
      3  -0.938218D+01 -0.109653D+01  0.346367D+00 -0.773677D+00 -0.600068D+01
      4  -0.992059D+01  0.679401D+00  0.111023D+01  0.161417D+01  0.185974D+01
      5   0.351604D+00 -0.221084D+01  0.227640D+02  0.101170D+01 -0.401585D+01
      6   0.106610D+01  0.147388D+01  0.445945D+00  0.195430D+01 -0.345359D+00
               271           272           273           274           275 
      1   0.427552D+01  0.467477D+01  0.944355D+01  0.207393D+02  0.841916D+01
      2  -0.108282D+01 -0.248499D+01 -0.498317D+01 -0.595167D+01  0.506400D+01
      3  -0.319270D+01 -0.218978D+01 -0.446037D+01 -0.147877D+02 -0.134832D+02
      4   0.242266D+01  0.824305D+00  0.250166D+01  0.346974D+02  0.422466D+02
      5   0.949875D+01  0.152093D+01 -0.385878D+01  0.159060D+02  0.248987D+02
      6   0.198357D+01 -0.110747D+00 -0.194262D+01  0.618204D+01  0.886650D+01
               276           277           278           279 
      1   0.313360D+01  0.334926D+02  0.742203D+01  0.115149D+01
      2   0.331592D+01 -0.151081D+02 -0.172723D+00 -0.181144D+01
      3  -0.644952D+01 -0.183845D+02 -0.724930D+01  0.659951D+00
      4   0.253435D+02  0.254452D+02  0.271362D+02  0.268308D+02
      5   0.285830D+02  0.238206D+02  0.259740D+02  0.356890D+02
      6   0.958741D+01  0.849286D+01  0.948870D+01  0.101392D+02

 ----------------------------------------------------------------------

 Electric dipole moment (input orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.240816D+01      0.612094D+01      0.204172D+02
   x          0.203986D+01      0.518480D+01      0.172946D+02
   y          0.124898D+01      0.317459D+01      0.105893D+02
   z          0.279794D+00      0.711167D+00      0.237220D+01

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.181956D+03      0.269631D+02      0.300005D+02
   aniso      0.141608D+03      0.209841D+02      0.233480D+02
   xx         0.269967D+03      0.400049D+02      0.445115D+02
   yx        -0.874666D+01     -0.129612D+01     -0.144213D+01
   yy         0.163260D+03      0.241926D+02      0.269179D+02
   zx        -0.992469D+01     -0.147069D+01     -0.163636D+01
   zy        -0.770018D+01     -0.114105D+01     -0.126959D+01
   zz         0.112642D+03      0.166918D+02      0.185721D+02

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  514.5nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.200315D+03      0.296836D+02      0.330275D+02
   aniso      0.165099D+03      0.244651D+02      0.272211D+02
   xx         0.303178D+03      0.449263D+02      0.499872D+02
   yx        -0.125945D+02     -0.186632D+01     -0.207656D+01
   yy         0.177410D+03      0.262895D+02      0.292510D+02
   zx        -0.102746D+02     -0.152254D+01     -0.169406D+01
   zy        -0.850368D+01     -0.126011D+01     -0.140207D+01
   zz         0.120356D+03      0.178350D+02      0.198441D+02

 ----------------------------------------------------------------------

 Dipole orientation:
     6          0.36125389         -1.41816607          0.38114616
     6          0.33537355          0.10439936          2.60215662
     6         -0.74473635         -0.48473850         -1.85458977
     6         -1.84788188          1.87242791         -1.95451860
     6         -1.85617608          3.37046125          0.25640695
     6         -0.80238746          2.51602034          2.46521111
     6          1.50757576         -3.83826483          0.50840758
     1         -0.70548700         -1.66899112         -3.52681280
     1         -2.71980433          5.22583667          0.19444790
     1         -0.83238018          3.69427354          4.13872995
     6         -3.06978166          2.83128605         -4.35832183
     6         -5.50723755          1.41894889         -5.01119237
     6         -1.26410705          2.87514876         -6.62690359
     1         -3.54284398          4.82613786         -4.06114158
     1         -5.12520359         -0.57863706         -5.34009455
     1         -6.35551079          2.19350511         -6.71679318
     1         -6.84621825          1.57249724         -3.45338823
     8         -1.92144060          2.57213029         -8.77187145
     8          1.17958667          3.40782598         -6.09285575
     1          1.42811583          3.39760480         -4.27866804
     6          2.55994471         -4.69700004          2.69697929
     6          2.53035262         -3.17759881          4.90482844
     6          1.44023797         -0.82133312          4.85845617
     8          3.63768205         -4.24871136          6.95464317
     6          3.69006929         -2.84861559          9.23896650
     1          1.53839465         -5.00695397         -1.17125557
     1          3.43762807         -6.53934371          2.81107885
     1          1.39938037          0.36530291          6.51867992
     1          4.73574033         -1.08085059          9.00807832
     1          4.64842044         -4.03782764         10.61233927
     1          1.77813230         -2.43037751          9.90326749

 Electric dipole moment (dipole orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.240816D+01      0.612094D+01      0.204172D+02
   x          0.000000D+00      0.000000D+00      0.000000D+00
   y          0.000000D+00      0.000000D+00      0.000000D+00
   z          0.240816D+01      0.612094D+01      0.204172D+02

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.181956D+03      0.269631D+02      0.300005D+02
   aniso      0.141608D+03      0.209841D+02      0.233480D+02
   xx         0.143884D+03      0.213215D+02      0.237233D+02
   yx        -0.390564D+02     -0.578757D+01     -0.643954D+01
   yy         0.173411D+03      0.256968D+02      0.285916D+02
   zx         0.490059D+02      0.726192D+01      0.807998D+01
   zy        -0.301572D+02     -0.446884D+01     -0.497226D+01
   zz         0.228573D+03      0.338710D+02      0.376866D+02

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  514.5nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.200315D+03      0.296836D+02      0.330275D+02
   aniso      0.165099D+03      0.244651D+02      0.272211D+02
   xx         0.156607D+03      0.232067D+02      0.258209D+02
   yx        -0.459020D+02     -0.680197D+01     -0.756822D+01
   yy         0.191572D+03      0.283880D+02      0.315859D+02
   zx         0.566023D+02      0.838760D+01      0.933246D+01
   zy        -0.374974D+02     -0.555655D+01     -0.618249D+01
   zz         0.252766D+03      0.374561D+02      0.416755D+02

 ----------------------------------------------------------------------
 1\1\GINC-CPN-U24-38\Freq\RB3LYP\Gen\C14H14O3\PIERPA\12-Aug-2021\0\\#P 
 B3LYP/Gen EmpiricalDispersion=GD3BJ Integral=UltraFineGrid SCF=(NoSymm
 ,MaxCyc=120) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq\\ROA calculat
 ions.\\0,1\C,0.534503,-0.540241,0.250726\C,1.208047,0.686254,-0.018994
 \C,-0.871111,-0.548582,0.352837\C,-1.61536,0.600511,0.194237\C,-0.9379
 03,1.810722,-0.077253\C,0.429321,1.854269,-0.179299\C,1.312272,-1.7161
 02,0.408925\H,-1.366601,-1.491361,0.557454\H,-1.515348,2.718805,-0.203
 162\H,0.928391,2.793066,-0.386339\C,-3.123514,0.580399,0.330991\C,-3.5
 82702,0.341624,1.771049\C,-3.808238,-0.400692,-0.62991\H,-3.495206,1.5
 61723,0.013814\H,-3.241865,-0.630545,2.127829\H,-4.668885,0.361293,1.8
 33837\H,-3.169487,1.109726,2.424876\O,-4.830838,-0.974186,-0.383978\O,
 -3.217917,-0.549143,-1.838643\H,-2.355614,-0.1071,-1.835698\C,2.671053
 ,-1.679537,0.30745\C,3.338655,-0.457152,0.039453\C,2.621063,0.703564,-
 0.121448\O,4.689861,-0.555418,-0.036901\C,5.432086,0.622962,-0.304199\
 H,0.808612,-2.652916,0.612592\H,3.271812,-2.571003,0.426688\H,3.110374
 ,1.644342,-0.326736\H,5.158044,1.051824,-1.272282\H,6.47652,0.322638,-
 0.322951\H,5.281369,1.371486,0.478872\\Version=ES64L-G16RevA.03\State=
 1-A\HF=-767.9724313\RMSD=5.543e-09\RMSF=1.006e-05\ZeroPoint=0.2505554\
 Thermal=0.265801\Dipole=2.0398559,1.2489784,0.2797944\DipoleDeriv=-0.1
 521,-0.0266312,0.0162445,-0.1473533,-0.129219,0.0354592,0.0443963,0.02
 29432,-0.0023967,0.4495457,-0.0696909,-0.0166847,-0.0542365,-0.0952724
 ,0.0224638,-0.019145,0.0248625,0.0078981,0.0958147,-0.0479419,0.007227
 5,0.0145212,0.0663112,-0.0464725,-0.0266624,-0.0343918,-0.1005174,0.13
 5423,0.0943529,-0.0508439,0.1179398,-0.1421469,-0.0081738,-0.2140328,-
 0.0108938,-0.1617107,-0.1276756,0.0066895,0.0027853,0.030711,0.1149734
 ,-0.0315475,-0.0283049,-0.0398129,-0.1274169,-0.0941047,0.0176558,-0.0
 038112,0.0748594,0.1248179,-0.0506565,-0.0075352,-0.0445092,-0.1112464
 ,0.1540488,-0.0542478,-0.0095293,-0.0707573,0.1552722,-0.0442356,-0.01
 13084,-0.043175,-0.1025865,0.032435,-0.0398515,0.0112781,-0.0900534,-0
 .0250212,0.0315897,0.0251211,0.0296835,0.1037232,0.0008093,0.0928559,-
 0.0096096,0.0834937,-0.0290746,0.0214403,-0.0054593,0.0207936,0.117578
 5,0.0057787,-0.0847285,0.0224819,-0.0457359,-0.0470929,0.033534,0.0142
 267,0.036674,0.1120772,0.1646965,-0.1124295,-0.0430831,-0.2520923,-0.0
 070464,-0.1512784,0.061223,-0.0931631,0.038023,-0.114477,-0.0048142,0.
 0237953,0.0089606,0.0926917,0.0114112,-0.0511266,0.039698,0.0544127,1.
 4542556,0.4606277,-0.3421779,0.7663806,0.5939805,0.2599556,-0.3553949,
 0.138977,1.2519465,0.0053039,-0.0101953,-0.0172056,0.0527996,-0.057459
 3,0.0494165,-0.0416215,0.0407472,-0.0098389,0.054406,0.07166,-0.018089
 8,0.0536397,-0.0654832,0.0636224,-0.0022106,0.0045212,0.0183696,-0.132
 3283,0.0193661,0.054797,-0.0049514,0.0857282,0.0220007,0.0723708,0.004
 5249,0.0502555,0.0647994,-0.0671499,-0.0589321,-0.0454997,-0.0339981,-
 0.0909794,-0.0467344,-0.051643,-0.031807,-1.2108515,-0.2868223,0.15412
 04,-0.5882225,-0.5278802,0.0003842,0.0203599,-0.0475941,-0.5577161,-0.
 7445361,-0.0548589,0.2265255,-0.0634049,-0.3220542,-0.154788,0.3417758
 ,-0.0165759,-1.0791929,0.3627681,-0.0177198,0.0374148,0.0479764,0.1959
 678,0.0132895,0.2094253,0.0067527,0.3773251,-0.3560229,0.0060113,0.011
 8943,-0.2028032,0.078492,-0.0264264,0.0521004,-0.0409224,-0.1416843,1.
 9647236,0.006153,-0.1273765,-0.1664764,0.1201002,0.0048626,-0.1002123,
 -0.0057957,0.0970941,-0.5088041,0.0128824,0.0180958,0.4131732,-0.07730
 48,-0.0449147,-0.0519996,-0.0189978,-0.1719527,-2.2183087,-0.0854562,0
 .1470495,-0.3305169,-0.4803971,0.0656542,0.1975464,0.0491298,-0.266867
 3,0.7102012,0.1439659,-0.0523735,0.6665853,0.4770746,-0.0734828,-0.148
 7113,-0.0390268,0.3357731,0.0240576,-0.0828667,0.0222029,-0.0331354,-0
 .032404,0.0302904,0.0137419,0.0331297,0.1123022,0.0305707,0.0641399,-0
 .0043788,0.0611172,0.0003041,0.0209278,-0.0031613,0.0204997,0.1350928,
 0.033898,-0.0259409,0.0116713,-0.0948445,-0.0251941,0.0359095,0.024111
 2,0.0314203,0.1294572,0.0284558,0.0275783,-0.0841087,-0.1233855,-0.006
 4717,0.0533693,0.0178948,0.06455,-0.1022153,-0.1503233,0.0058118,0.015
 5188,0.0540061,0.0534628,0.0027988,0.0070117,0.0062049,0.0882252,0.037
 5403,0.0415952,0.0551017,-0.1326948,-0.0556565,-0.0554241,0.0123151,-0
 .0886108,-0.0624048\Polar=269.9667241,-8.7466592,163.2596854,-9.924685
 2,-7.7001848,112.6418117\Quadrupole=-6.3109596,6.804765,-0.4938054,-3.
 9457669,-5.834387,-3.2439502\PG=C01 [X(C14H14O3)]\NImag=0\\0.68647468,
 -0.02658117,0.62816223,-0.03231926,-0.08327086,0.17697008,-0.16425320,
 -0.04801575,0.01479727,0.67610176,-0.04216195,-0.22262119,0.02916022,-
 0.02742549,0.63123853,0.01384930,0.02972677,-0.08387949,-0.03050614,-0
 .08315992,0.18211901,-0.28768482,-0.00381182,0.01687045,-0.01223058,-0
 .05356866,0.01085885,0.66079542,-0.03418799,-0.11195142,0.01105420,-0.
 03732903,0.02325623,-0.00054804,-0.00199349,0.71713051,0.02318991,0.00
 928278,-0.06756082,0.00815022,-0.00001807,0.00511370,-0.03649405,-0.10
 480912,0.16128233,-0.03325590,0.03240801,-0.00356623,0.00509064,0.0014
 1494,-0.00077988,-0.18702752,0.12814169,-0.01448627,0.62061393,0.06839
 369,0.00717755,-0.00445113,0.01852195,-0.04818639,0.00645085,0.0720851
 7,-0.28196030,0.03442186,-0.03347503,0.64730448,-0.01091516,-0.0030229
 5,0.00809747,-0.00401235,0.00805198,-0.00674545,-0.00198704,0.03036880
 ,-0.07082468,-0.02584384,-0.08151668,0.19517065,-0.03988384,-0.0077433
 5,0.00387979,-0.05101960,0.05607969,-0.00665878,0.05402464,-0.01772865
 ,0.00060244,-0.15392394,-0.02991657,0.01329364,0.71778415,-0.02806926,
 -0.00338073,0.00157372,0.02146557,0.02843849,-0.00590307,0.02270493,-0
 .06119115,0.01180351,-0.09404143,-0.23567019,0.03850191,-0.05456908,0.
 65782167,0.00682258,0.00027219,-0.00574612,-0.00036942,-0.00753334,0.0
 0627489,-0.00672321,0.01358176,0.00676355,0.02362941,0.03450282,-0.070
 73644,-0.03198312,-0.09342868,0.14861260,0.05296953,0.00510670,-0.0041
 8611,-0.14784902,0.05368881,-0.00403037,-0.04223652,0.02630911,-0.0027
 2074,-0.02558898,-0.07298112,0.01497426,-0.37429850,0.02261583,0.01896
 468,0.71969707,-0.00873560,-0.03982108,0.00907165,0.08402196,-0.244152
 58,0.02688409,0.01800730,-0.01287696,0.00048578,-0.03094005,0.02309015
 ,-0.00004537,-0.03569420,-0.12669763,0.01459561,0.04057107,0.66454793,
 -0.00158764,0.00809174,0.00501172,-0.00965869,0.02895819,-0.07020264,-
 0.00072856,0.00017970,-0.00303621,0.00772512,0.00156961,0.00566607,0.0
 2859608,0.01120268,-0.06108717,-0.04824717,-0.10086159,0.15114694,-0.1
 4174684,0.05317479,-0.00435928,0.04777476,0.00340214,-0.00346420,-0.05
 071879,0.04428138,-0.00462405,-0.00157104,-0.02282406,0.00518192,0.011
 73005,0.01000628,-0.00249273,-0.01212680,0.00280864,0.00061296,0.73946
 187,0.07865178,-0.23924480,0.02604542,-0.00869467,-0.04033512,0.009161
 90,0.02589710,-0.00336941,-0.00042521,-0.00474718,0.01621331,-0.001851
 53,-0.00938292,-0.00702113,0.00155990,0.00352101,-0.00709265,0.0018780
 0,0.04511213,0.65970476,-0.00896359,0.02777375,-0.06974351,-0.00116466
 ,0.00846436,0.00565654,-0.00085391,-0.00203106,0.00343231,0.00128228,-
 0.00016832,0.00627557,0.00078444,0.00039363,-0.00100079,0.00050696,0.0
 0188783,0.00400520,-0.05043972,-0.09854919,0.15299599,-0.01100325,-0.0
 2857367,0.00626149,-0.00528751,0.00176911,0.00045353,-0.11623727,-0.10
 639553,0.02438817,0.01188233,0.01483453,-0.00316486,-0.00151430,0.0032
 7954,0.00006719,-0.00066557,0.00058403,-0.00011663,0.00148528,-0.00183
 448,-0.00003193,0.12096985,0.00017120,0.00144554,0.00036083,0.00064736
 ,0.00160175,0.00066602,-0.10635968,-0.26164077,0.04823494,-0.01417100,
 -0.01982975,0.00534640,0.00437769,-0.00227769,0.00146810,0.00042834,0.
 00031098,-0.00022423,0.00153604,0.00077375,-0.00084510,0.11528081,0.27
 934859,0.00110408,0.00235913,0.00311742,0.00061392,0.00056862,0.005362
 66,0.02465886,0.04763576,-0.04750350,0.00156694,0.00351194,0.00332214,
 -0.00020449,0.00163377,0.00708517,-0.00010470,-0.00022529,-0.00072840,
 -0.00062891,-0.00062180,-0.00316741,-0.02736185,-0.05438282,0.03690869
 ,-0.00068876,-0.00031985,0.00003391,-0.00524862,-0.00183405,0.00131641
 ,-0.00080669,-0.00304030,0.00099384,0.00893274,-0.01217651,0.00170611,
 -0.13500147,0.12178864,-0.01545590,-0.01297353,0.02856676,-0.00407611,
 0.00038172,-0.00011660,-0.00005056,0.00049060,-0.00068637,0.00015558,0
 .14313866,-0.00083821,0.00027467,-0.00018050,-0.00107365,0.00187540,0.
 00138764,-0.00391055,-0.00321317,0.00174868,0.01619130,-0.01935267,0.0
 0274526,0.12149182,-0.25042860,0.03086024,-0.00185362,0.00420981,-0.00
 018673,0.00017883,-0.00008102,-0.00011981,0.00088198,-0.00100884,0.000
 20120,-0.13193592,0.26537982,0.00009725,-0.00021301,-0.00096123,0.0011
 5322,0.00144373,0.00870917,0.00114013,0.00163931,0.00461729,-0.0035149
 2,0.00500985,0.00174511,-0.01521875,0.03080237,-0.03963152,0.00137784,
 -0.00222087,0.00268632,-0.00008798,-0.00010174,-0.00063902,-0.00015839
 ,0.00029868,0.00033659,0.01596078,-0.03475911,0.03007413,-0.00147500,0
 .00276329,-0.00005171,0.01052417,0.01487443,-0.00321345,-0.00068363,0.
 00070019,-0.00014555,-0.00512635,0.00157010,0.00065760,-0.01051204,-0.
 02957332,0.00638082,-0.11610454,-0.10822023,0.02544347,0.00033616,0.00
 083889,-0.00017251,0.00006421,-0.00012414,-0.00006314,0.00099427,0.000
 24809,-0.00043216,0.12122102,0.00417614,-0.00206014,0.00108984,-0.0142
 8323,-0.01952967,0.00515019,0.00092476,0.00008016,-0.00024015,0.000393
 10,0.00223664,0.00103984,0.00108609,0.00253079,-0.00006401,-0.10838990
 ,-0.26470194,0.04979684,-0.00125926,-0.00079238,0.00021466,-0.00012092
 ,-0.00008513,-0.00017827,-0.00038853,0.00070592,-0.00094122,0.11766063
 ,0.28039129,-0.00029544,0.00117659,0.00517454,0.00213905,0.00312821,0.
 00243896,-0.00018205,-0.00019517,-0.00082996,0.00075805,0.00099591,0.0
 0800962,0.00067632,0.00209408,0.00225364,0.02555876,0.04979115,-0.0454
 5601,0.00020858,0.00007597,-0.00008472,-0.00006564,-0.00017795,-0.0010
 7046,-0.00031465,-0.00098641,-0.00437833,-0.02830803,-0.05523384,0.036
 20654,0.00312289,0.00155648,0.00035377,-0.00122877,-0.00012429,-0.0001
 7980,-0.02431766,0.00658412,0.00097750,-0.18353078,-0.00300756,0.00843
 748,-0.02190187,-0.00520674,0.00289097,0.00220318,-0.00127079,0.000639
 93,-0.00066556,0.00030962,0.00012528,0.00071111,-0.00132883,0.00014627
 ,0.00139566,0.00214185,-0.00066478,-0.00011240,0.00021103,0.00010103,0
 .48227736,0.00233080,-0.00428205,0.00178790,0.00005535,-0.00098121,0.0
 0003006,0.02743563,0.00476829,-0.00269785,0.00679190,-0.08667977,0.002
 53379,-0.02737621,0.00271340,0.00337041,-0.00151171,-0.00395043,0.0019
 9107,0.00094024,0.00060587,-0.00004789,0.00008672,0.00053958,-0.000764
 96,-0.00145917,0.00061975,-0.00076048,-0.00133734,-0.00005226,0.000031
 73,-0.02818934,0.51783235,-0.00011194,0.00270511,0.00647256,0.00018595
 ,-0.00031113,-0.00092440,-0.00458354,-0.00162298,0.00306899,0.00770411
 ,0.00152088,-0.07179195,0.00555983,0.00100560,0.00273903,-0.00001303,0
 .00140022,0.00578171,-0.00040154,0.00002086,0.00055733,-0.00007735,-0.
 00047978,-0.00377360,0.00020006,-0.00052774,-0.00288385,0.00006204,0.0
 0001411,0.00019560,-0.00532584,-0.03864272,0.45428193,0.00031307,-0.00
 032329,-0.00119570,0.00033241,-0.00037417,0.00024149,-0.00029352,-0.00
 125544,0.00139095,-0.01618967,-0.00536980,0.03287203,-0.00106920,0.002
 01801,0.00032652,-0.00114559,-0.00032065,-0.00111707,-0.00002122,-0.00
 009160,-0.00003742,-0.00014038,0.00029940,0.00027772,0.00006966,-0.000
 26836,0.00045123,-0.00021651,-0.00005951,-0.00003506,-0.08440589,-0.00
 549646,0.02752631,0.57263736,-0.00051280,-0.00020422,0.00023990,-0.000
 09827,0.00031931,-0.00011234,0.00162067,0.00016857,-0.00008522,-0.0024
 0543,0.00034710,-0.00019880,-0.00089943,-0.00054676,-0.00033638,0.0002
 2230,-0.00022238,-0.00032489,0.00016841,-0.00003233,0.00007814,0.00026
 192,-0.00030585,-0.00025749,0.00006971,0.00021416,0.00031360,0.0000122
 9,-0.00000570,0.00006247,-0.00524549,-0.07779246,0.01906823,-0.0020453
 7,0.57078821,0.00016558,0.00033739,0.00006493,-0.00017828,0.00004629,0
 .00005689,-0.00206857,0.00046793,0.00003721,0.01281875,0.00006682,-0.0
 0310612,-0.00202585,-0.00075671,-0.00037881,0.00005162,-0.00021294,-0.
 00015637,-0.00010721,-0.00012529,-0.00004999,0.00002827,0.00015816,0.0
 0013113,-0.00002837,0.00001914,0.00013586,-0.00012634,-0.00002671,0.00
 008107,0.02178824,0.01881637,-0.16224907,0.03694915,0.01883720,0.46870
 788,-0.00060443,0.00012367,0.00100233,-0.00020242,0.00011044,-0.000314
 67,0.00074928,0.00022723,0.00146100,-0.02169563,-0.02376002,-0.0149927
 3,-0.00288585,0.00080349,-0.00018837,-0.00021787,-0.00074468,0.0007845
 4,0.00024089,0.00035917,0.00001103,0.00022488,0.00082418,-0.00135011,-
 0.00004228,-0.00032487,-0.00032033,-0.00012425,0.00005272,0.00005593,-
 0.09026027,-0.00691714,-0.01876191,0.00780267,0.00642485,-0.00019876,0
 .80346739,0.00008877,-0.00122413,0.00032020,-0.00036467,0.00027552,0.0
 0013719,0.00362652,0.00248046,-0.00135965,-0.01075406,0.00100313,0.006
 52086,0.00172548,-0.00104431,-0.00038615,0.00038277,0.00036081,-0.0001
 9050,0.00022753,0.00051144,-0.00034573,0.00014098,-0.00050957,0.000508
 06,-0.00022934,0.00006803,-0.00010938,0.00035280,0.00006357,-0.0000805
 8,-0.00745210,-0.10722368,-0.02303886,0.00786198,0.00426010,-0.0036154
 3,0.32006479,0.45599334,0.00092513,-0.00063539,-0.00018393,0.00040538,
 -0.00011498,0.00033484,0.00242606,-0.00182747,-0.00243078,-0.01092811,
 0.00545131,0.00155754,0.00566720,0.00076448,-0.00246100,0.00034728,0.0
 0088701,-0.00076416,0.00016343,0.00020926,-0.00021160,-0.00084280,0.00
 016188,0.00107889,-0.00020026,-0.00037688,0.00080768,0.00048670,0.0001
 3856,0.00006610,-0.02001521,-0.02775621,-0.11076596,-0.00955693,-0.023
 17473,-0.03097358,-0.13534628,0.03150304,0.49163402,0.00005287,0.00151
 119,-0.00003834,0.00029687,-0.00013579,-0.00003445,-0.00633055,-0.0019
 6878,0.00064388,-0.01608566,0.03120493,-0.00810957,0.00147472,0.002521
 80,-0.00028845,-0.00024432,-0.00012067,0.00004319,-0.00054561,-0.00009
 512,0.00010960,0.00011747,-0.00008091,-0.00012834,-0.00002954,-0.00132
 305,0.00017392,0.00005114,-0.00000385,-0.00002563,-0.07078642,0.069581
 52,-0.02430206,0.00307479,-0.00899239,0.00393452,0.00570615,-0.0140760
 6,0.00519969,0.08614229,-0.00035644,-0.00006691,0.00013885,-0.00015320
 ,0.00020891,-0.00000718,0.00031265,0.00063180,0.00012474,0.00079463,-0
 .00090189,-0.00011496,-0.00294001,0.00049832,-0.00014109,0.00028018,0.
 00026285,-0.00021560,0.00009056,-0.00000559,-0.00000893,-0.00017285,0.
 00016107,-0.00006782,0.00011828,0.00063517,0.00005979,0.00004751,-0.00
 001090,-0.00000110,0.07835641,-0.24971799,0.06195883,0.00075468,-0.003
 94240,0.00305293,0.00671769,-0.02600082,0.00693331,-0.07973191,0.27225
 456,0.00016732,0.00003880,0.00020023,0.00004309,-0.00002558,0.00006723
 ,0.00051880,0.00005804,0.00093744,0.00160352,-0.00185674,0.00035424,0.
 00058916,-0.00010584,0.00008144,-0.00004755,-0.00013242,-0.00007905,-0
 .00001011,-0.00001298,-0.00009814,-0.00001286,0.00003353,-0.00021672,-
 0.00007762,-0.00011849,0.00025590,-0.00002673,-0.00000974,-0.00005762,
 -0.02433666,0.05706777,-0.06248945,-0.00920280,0.03063625,-0.01323192,
 0.00852612,-0.02030493,0.00751529,0.02404556,-0.06760677,0.07387472,-0
 .00025429,0.00004692,-0.00003527,-0.00005966,0.00015068,-0.00003070,0.
 00010236,-0.00001385,0.00004120,0.00106692,-0.00088530,-0.00053212,-0.
 00031703,-0.00026259,-0.00007799,0.00026792,-0.00003401,0.00004088,0.0
 0007173,-0.00003291,0.00000879,-0.00019654,0.00019275,0.00045185,-0.00
 000326,0.00007669,-0.00002347,0.00001431,0.00000396,-0.00000606,0.0020
 2641,-0.00965638,0.00388841,-0.07411911,0.07638489,-0.02730189,0.00071
 076,0.00081729,-0.00100299,0.00009861,-0.00046372,0.00232428,0.0758357
 6,-0.00035346,0.00013666,-0.00012282,-0.00005086,0.00015780,0.00000857
 ,-0.00009440,-0.00014372,-0.00045608,0.00080185,0.00028752,-0.00022545
 ,-0.00028102,-0.00021854,0.00006383,0.00021520,0.00002619,-0.00001111,
 0.00004826,-0.00007274,-0.00001699,0.00019089,0.00036041,0.00003335,0.
 00000844,0.00009687,-0.00004443,-0.00000620,-0.00000247,0.00000832,0.0
 0075146,-0.00370487,0.00241158,0.07543833,-0.25870915,0.07455549,-0.00
 121433,0.00000286,-0.00079391,-0.00037452,0.00129556,0.00053533,-0.083
 51694,0.27937257,0.00046893,-0.00035216,0.00010076,0.00005966,-0.00028
 085,0.00003342,-0.00012143,0.00058429,0.00012341,-0.00166706,-0.000477
 97,0.00124867,0.00052515,0.00034888,0.00018182,-0.00038424,0.00003928,
 0.00004938,-0.00009907,0.00012566,-0.00003514,0.00030359,-0.00047004,-
 0.00030931,-0.00003997,-0.00015977,-0.00003822,0.00000390,0.00000008,-
 0.00002954,-0.00977634,0.02864715,-0.01349569,-0.02602515,0.07242373,-
 0.07213901,0.00143583,0.00264751,0.00124294,0.00195940,0.00055333,-0.0
 0590937,0.02684551,-0.08282543,0.08143671,-0.00003955,-0.00004825,0.00
 000160,0.00016515,-0.00008062,0.00002394,0.00040142,-0.00046973,0.0002
 2936,0.00003820,-0.00073648,0.00178528,0.00004648,0.00055452,0.0001874
 7,-0.00026046,-0.00003014,-0.00008765,0.00000776,-0.00005816,-0.000000
 85,0.00001452,-0.00002991,-0.00009466,-0.00000091,-0.00004062,0.000024
 97,-0.00004494,-0.00001201,-0.00002671,-0.00830296,0.00068056,0.001017
 93,-0.31676729,0.00737761,0.01436101,-0.00213517,-0.00138320,0.0001127
 3,0.00054909,-0.00025779,0.00015014,-0.00876818,0.00008789,0.00016411,
 0.34317209,-0.00043288,0.00005315,-0.00026226,-0.00004681,0.00024194,-
 0.00004190,0.00024888,-0.00012147,-0.00007273,0.00029988,0.00072278,0.
 00097130,-0.00027752,-0.00009802,-0.00006991,0.00029930,-0.00004343,-0
 .00006231,0.00010055,-0.00012258,-0.00001794,-0.00004286,0.00024857,0.
 00035166,-0.00001813,-0.00000092,-0.00000123,-0.00000548,-0.00000345,0
 .00003579,-0.00619926,-0.00114439,0.00110668,0.00585996,-0.04762154,-0
 .00001560,0.00149250,0.00076302,-0.00076846,-0.00035353,0.00024449,-0.
 00041022,0.02952662,-0.00006466,-0.00203708,-0.00605341,0.04678968,0.0
 0005970,-0.00004585,0.00034915,-0.00007061,0.00005074,-0.00007371,0.00
 035683,0.00030891,-0.00002818,0.00002405,0.00073016,-0.00557617,0.0006
 6312,-0.00033886,-0.00005714,0.00025532,0.00011581,0.00028943,0.000024
 99,0.00008426,0.00000693,-0.00003438,-0.00019316,-0.00016434,-0.000044
 64,0.00005691,-0.00014696,0.00008946,0.00002446,0.00000987,0.03260212,
 -0.00110771,-0.00309176,0.01050809,0.00033828,-0.04724994,0.00284261,0
 .00048147,-0.00034475,-0.00025894,0.00020257,0.00150889,-0.01009716,-0
 .00067730,0.00011957,-0.01544255,-0.00168778,0.05213561,-0.00004831,-0
 .00003278,-0.00000887,-0.00002865,0.00000255,-0.00000326,0.00003952,0.
 00017176,-0.00016769,0.00069864,0.00067956,0.00019161,0.00018517,-0.00
 016151,-0.00003103,-0.00003656,0.00001832,-0.00001845,-0.00000455,0.00
 002770,-0.00001331,0.00003871,-0.00005509,0.00005461,0.00001965,0.0000
 0764,0.00000803,0.00002058,0.00000574,0.00000245,0.00267260,0.00809326
 ,0.00801540,-0.08679746,-0.07211147,-0.06126836,-0.00253990,-0.0021661
 3,0.00188284,0.00008317,-0.00008205,-0.00071819,0.00364194,0.00760702,
 0.00740040,-0.00946046,-0.02310652,-0.01912296,0.08962774,0.00003934,0
 .00011401,-0.00001350,0.00006118,-0.00001831,-0.00000619,0.00018239,-0
 .00048018,0.00014912,-0.00017963,0.00042560,0.00016532,0.00027785,0.00
 021979,-0.00003627,0.00002020,0.00000861,0.00001043,-0.00000441,-0.000
 02000,0.00000279,-0.00007546,0.00013429,-0.00003303,0.00001603,-0.0000
 5419,-0.00002292,0.00000739,0.00000539,-0.00000351,0.00278622,0.004087
 07,0.00456436,-0.07153656,-0.18169513,-0.11190230,-0.00184137,-0.00007
 280,0.00209927,0.00035736,0.00082348,-0.00046203,-0.01163048,-0.019424
 16,-0.01732195,0.00055748,0.00101945,0.00214323,0.08001538,0.19393978,
 -0.00025396,-0.00008661,-0.00011815,-0.00003798,0.00014872,-0.00006692
 ,0.00056193,-0.00011927,0.00028063,-0.00146174,0.00001711,0.00101106,0
 .00008427,-0.00002464,0.00020682,0.00028501,0.00006640,-0.00004578,0.0
 0009982,-0.00008140,0.00001394,-0.00002489,0.00006057,0.00004070,-0.00
 001794,0.00005851,-0.00012256,0.00002219,-0.00000521,-0.00000219,-0.01
 164802,-0.02192245,-0.02053812,-0.05921965,-0.11000868,-0.13815409,0.0
 0364320,0.00345368,-0.00345683,-0.00055657,0.00010775,0.00134806,0.004
 86432,0.00705970,0.00678825,0.00023279,0.00248543,0.00114198,0.0644109
 6,0.12107277,0.15371418,-0.00002879,0.00018655,0.00001703,0.00034602,-
 0.00003039,0.00003153,0.00025657,-0.00127737,-0.00029627,0.00169645,-0
 .00288041,-0.00334939,-0.00151270,0.00069837,-0.00032513,-0.00013275,-
 0.00001643,0.00043655,0.00003207,-0.00041188,0.00005659,-0.00013108,0.
 00009573,0.00013775,0.00006374,0.00018115,-0.00010942,-0.00020890,-0.0
 0006733,0.00004219,-0.02030583,-0.02987989,0.00307470,-0.00183497,0.00
 143057,0.00459538,-0.56736642,-0.28744624,0.08777301,-0.00304184,-0.00
 238801,-0.00254074,0.00010578,0.00060727,-0.00086655,0.00121689,-0.000
 64343,-0.00186354,0.00113781,0.00050540,-0.00020902,0.64080780,-0.0002
 0170,0.00061218,0.00010296,0.00038469,-0.00010148,-0.00005736,-0.00048
 441,-0.00163848,0.00066521,0.00146915,-0.00498540,-0.00572362,-0.00195
 691,0.00106530,-0.00017763,-0.00030493,-0.00028177,0.00051356,-0.00004
 258,-0.00043436,0.00013670,-0.00015455,0.00024290,-0.00028144,0.000103
 55,0.00002102,-0.00014705,-0.00026591,-0.00004525,0.00005563,-0.039748
 29,-0.00447543,-0.00200226,-0.00103114,-0.00074567,0.00147397,-0.28252
 003,-0.24563319,0.04124639,0.00084885,0.00198337,0.00122228,-0.0006758
 1,0.00042622,-0.00107659,-0.00028993,-0.00079674,-0.00046856,0.0003173
 1,0.00049077,-0.00045369,0.33955326,0.23323493,-0.00030710,0.00005441,
 0.00007154,-0.00006255,0.00003438,-0.00010165,-0.00017778,0.00055784,0
 .00085063,0.00061748,-0.00350996,-0.00009099,-0.00168374,0.00001872,0.
 00057603,-0.00014859,-0.00029706,0.00021853,-0.00000241,-0.00004368,0.
 00004419,0.00019694,-0.00005125,-0.00037462,0.00005043,0.00010700,-0.0
 0024700,-0.00014936,-0.00003894,-0.00001553,-0.01227083,-0.01004905,0.
 01164505,-0.00022815,-0.00179273,-0.00031570,0.09866822,0.04735472,-0.
 11895913,-0.00161632,-0.00280714,-0.00139529,0.00048457,0.00000779,0.0
 0050703,-0.00241235,-0.00011069,-0.00009172,-0.00139150,-0.00069259,0.
 00037044,-0.15343770,-0.05595014,0.13474513,0.00097379,-0.00034351,-0.
 00022694,0.00069257,-0.00060062,0.00033781,0.00074123,-0.00267874,-0.0
 0252852,-0.00469525,-0.00035031,-0.00570766,0.00252339,0.00199076,-0.0
 0091679,-0.00115322,0.00044859,0.00012264,-0.00018761,0.00000517,0.000
 01427,-0.00043845,-0.00015461,0.00064316,-0.00001676,-0.00020241,0.000
 11475,-0.00000064,-0.00000602,0.00000891,0.00874907,-0.00429602,-0.000
 62283,0.00063030,-0.00083210,-0.00078890,-0.10367604,-0.00239709,0.066
 23026,-0.00018002,-0.00138983,-0.00118993,-0.00033474,-0.00000902,0.00
 002381,0.00047694,-0.00053480,-0.00094819,0.00038948,0.00034252,-0.000
 03193,-0.05534527,-0.01464561,0.07114553,0.52899617,-0.00106834,0.0003
 4155,0.00016535,0.00009506,0.00024916,-0.00002458,0.00101111,-0.001227
 06,0.00114479,0.00016631,-0.00027984,-0.00338387,-0.00008316,0.0005173
 1,-0.00025874,0.00015821,0.00011341,-0.00006379,0.00013263,-0.00032631
 ,0.00012758,0.00020299,0.00036525,-0.00068701,0.00006519,0.00016691,0.
 00004595,-0.00006808,-0.00001802,0.00002118,0.00429984,0.00973060,-0.0
 2714379,-0.00416414,-0.00392839,-0.00125584,-0.02287707,-0.08154433,-0
 .04011430,0.00102055,0.00226090,0.00210621,-0.00004357,0.00014391,-0.0
 0044886,0.00019889,-0.00015361,-0.00003202,0.00072992,0.00047822,-0.00
 180163,-0.01919429,0.01427704,0.03063144,0.22337697,0.17410637,0.00008
 244,0.00019169,-0.00017005,0.00000531,-0.00035660,-0.00006555,-0.00203
 277,0.00000089,0.00004145,0.00446474,-0.00066715,-0.00226723,-0.000800
 90,0.00039977,0.00079259,-0.00085553,-0.00005731,0.00030729,-0.0002604
 9,0.00002822,0.00013727,0.00008537,-0.00009107,-0.00041847,0.00016863,
 0.00004507,-0.00041640,-0.00020380,-0.00007634,-0.00005995,0.01515164,
 -0.00906172,-0.02901662,-0.00398691,-0.00606831,-0.00129283,0.01646993
 ,-0.06726479,-0.23719263,-0.00061510,-0.00235805,-0.00266913,0.0000703
 4,0.00044412,0.00008463,-0.00013012,0.00048200,0.00103095,0.00082477,0
 .00037077,-0.00255397,0.05949283,0.02279261,-0.01873808,-0.10013079,0.
 06831187,0.33470612,-0.00041118,0.00014762,0.00006388,-0.00048765,0.00
 014013,-0.00011156,-0.00175964,0.00180025,-0.00025626,0.00384322,-0.00
 070936,0.00060536,-0.00124213,-0.00145340,0.00014850,0.00025726,-0.000
 17724,-0.00000613,-0.00002071,0.00016480,-0.00004160,0.00010111,-0.000
 17093,-0.00005453,0.00003077,0.00028280,0.00001339,0.00001629,0.000011
 28,0.00000761,0.00171188,0.00026768,-0.00313256,-0.00117060,-0.0008623
 2,-0.00032222,-0.02772474,-0.01013177,0.00571023,-0.00025415,0.0004235
 1,0.00022036,0.00006130,0.00019119,-0.00022245,-0.00010920,-0.00002898
 ,0.00016067,0.00029870,0.00007059,-0.00066339,0.00506562,0.00044508,0.
 00289027,-0.37767654,-0.18340211,0.01277298,0.39916581,0.00180310,-0.0
 0021408,-0.00044355,0.00009016,-0.00074055,0.00008210,-0.00213954,0.00
 102224,-0.00101011,0.00072529,-0.00015699,0.00018376,0.00020187,-0.000
 37903,0.00033040,-0.00114162,-0.00002103,0.00035405,-0.00040918,0.0004
 5809,-0.00002322,-0.00002568,-0.00035895,0.00070511,0.00004305,-0.0002
 3161,-0.00016441,0.00000165,0.00000758,-0.00004208,0.00074199,-0.00069
 560,-0.00205790,0.00004044,-0.00033147,-0.00000227,0.00343014,-0.00195
 838,0.00641777,0.00022964,-0.00065048,-0.00062954,-0.00001304,-0.00000
 134,0.00014801,-0.00000318,0.00005625,0.00007106,0.00006791,0.00000404
 ,-0.00007853,0.00061471,0.00638910,-0.00347301,-0.19783733,-0.11548561
 ,-0.00719593,0.19311054,0.11351624,-0.00040710,0.00018019,0.00014278,-
 0.00047269,0.00043426,-0.00012618,-0.00129031,0.00175986,-0.00025317,-
 0.00002581,-0.00130542,0.00024738,-0.00161760,-0.00173938,0.00016886,0
 .00113721,-0.00032027,-0.00026795,0.00017871,0.00011730,-0.00008744,0.
 00001535,0.00008057,-0.00011056,-0.00004846,0.00022590,0.00012925,0.00
 012817,0.00007369,0.00004773,0.00112264,-0.00130891,-0.00279206,-0.000
 06284,0.00035188,0.00006518,0.03667487,0.02370849,0.00330815,-0.000125
 98,0.00018561,0.00000002,0.00007644,0.00002083,0.00004147,-0.00010234,
 0.00007631,0.00028262,-0.00005794,-0.00007115,0.00013597,0.00735076,-0
 .00180326,-0.00863733,-0.02559693,-0.02723416,-0.04215056,-0.01780086,
 0.00675909,0.04983549,-0.05145781,0.04891377,-0.00480882,-0.03378976,-
 0.00736861,0.00343485,0.02151689,-0.00560947,0.00005739,-0.00210016,0.
 01819540,-0.00348618,-0.01307758,-0.00869165,0.00223287,0.01115800,-0.
 00817440,0.00070363,-0.40452227,-0.03173253,0.03015570,0.00013522,-0.0
 0046888,0.00007347,-0.00024977,-0.00009058,0.00003529,0.00035614,0.000
 02275,-0.00003507,0.00030448,0.00020518,0.00000248,-0.00006075,-0.0001
 2002,-0.00009294,0.00024203,0.00038824,0.00030418,0.00005294,-0.000028
 33,0.00000433,-0.00004272,-0.00006897,0.00010763,-0.00004394,-0.000106
 72,0.00006551,0.00002803,0.00001130,-0.00009568,-0.00035745,-0.0003054
 0,-0.00009050,0.00007024,-0.00027981,-0.00006290,0.00007186,0.00046452
 ,0.00013018,0.76384998,0.01930818,0.02514422,-0.00480112,-0.02196501,-
 0.00272078,0.00138817,0.01277956,-0.00965726,0.00199622,-0.00044720,0.
 01133832,-0.00252621,-0.00836308,-0.00637314,0.00168844,0.00903939,-0.
 00591418,0.00033587,0.02039287,-0.12766085,0.01194979,0.00039578,-0.00
 000987,-0.00003627,-0.00022035,-0.00004249,0.00003374,0.00016021,0.000
 10017,-0.00004479,0.00031681,-0.00042160,0.00025586,-0.00014904,-0.000
 03392,-0.00009010,-0.00009610,0.00009611,0.00000472,0.00017514,-0.0000
 3498,-0.00001704,-0.00002629,-0.00005251,0.00006828,-0.00002415,-0.000
 08103,0.00006604,0.00001868,0.00000565,-0.00005205,-0.00012233,-0.0000
 8138,-0.00000897,0.00006676,-0.00014955,0.00003470,0.00000792,0.000259
 14,0.00001629,-0.05839674,0.65252645,0.00051122,-0.00691816,0.00739867
 ,0.00605178,0.00030261,-0.00431153,-0.00352415,0.00315745,0.00481417,0
 .00028654,-0.00338314,0.00060342,0.00242525,0.00177570,-0.00036578,-0.
 00243754,0.00150189,-0.00085450,0.02078867,0.01563909,-0.05815017,-0.0
 0007969,0.00001093,-0.00010538,0.00006350,0.00003525,0.00011088,-0.000
 06143,-0.00002911,-0.00005752,-0.00014314,-0.00002719,-0.00050163,0.00
 012496,-0.00000466,0.00001423,-0.00004455,-0.00001218,-0.00009884,-0.0
 0006164,-0.00000302,-0.00000538,0.00000232,0.00001029,-0.00002283,0.00
 000689,0.00003097,-0.00003943,-0.00000138,0.00000545,0.00002046,0.0000
 3510,0.00002268,0.00003539,-0.00004185,0.00006853,0.00007091,0.0000033
 9,-0.00011340,-0.00006654,-0.03412839,-0.09177862,0.14200098,0.0060750
 2,-0.00046634,-0.00075824,-0.03234589,0.03228173,-0.00366518,-0.003239
 90,0.00017791,0.00013561,0.00187592,-0.00084364,0.00069070,-0.00089653
 ,0.00128421,-0.00008029,-0.00205437,-0.00300498,0.00107487,-0.02707905
 ,-0.03051509,0.00765297,0.00028239,0.00030942,-0.00008488,-0.00023519,
 -0.00016036,0.00000039,-0.00003002,0.00014929,-0.00004301,-0.00076318,
 0.00032178,-0.00013708,0.00059354,0.00000649,0.00026581,-0.00128234,-0
 .00123473,-0.00029620,0.00011021,-0.00008148,0.00004264,-0.00008496,-0
 .00001777,0.00002821,0.00022828,0.00004744,-0.00024507,-0.00011132,-0.
 00000925,0.00009172,0.00123611,0.00092648,0.00011297,0.00079379,0.0003
 3181,0.00034205,-0.00055685,-0.00026438,-0.00087591,-0.13247875,-0.081
 14269,0.01915384,0.66201198,0.01928470,-0.04433972,0.00562470,0.070472
 22,0.00570062,-0.00597486,-0.01899270,0.00761203,-0.00030829,-0.000324
 77,-0.02241677,0.00395014,0.02161125,0.01216880,-0.00319858,-0.0259659
 1,0.01669993,-0.00028945,-0.07144771,0.02840431,0.00041074,-0.00028838
 ,0.00024364,-0.00004648,0.00005978,0.00025902,-0.00014842,-0.00045892,
 0.00005922,-0.00004754,0.00026184,-0.00041253,0.00001810,-0.00034379,0
 .00019014,-0.00004512,0.00022690,0.00030561,-0.00005437,-0.00015388,0.
 00006930,-0.00002106,0.00008980,0.00005997,-0.00013776,-0.00008759,0.0
 0008661,0.00009989,0.00001339,-0.00000294,0.00006276,-0.00019042,-0.00
 020345,0.00001339,-0.00046589,-0.00000875,-0.00024811,0.00017850,-0.00
 027145,0.00042117,-0.01843984,-0.24232359,0.03279701,-0.03669780,0.688
 89839,-0.00430746,0.00709700,-0.00654484,-0.01054925,-0.00334830,0.001
 21486,0.00364946,-0.00148901,-0.00039707,-0.00007047,0.00414545,-0.000
 66479,-0.00378838,-0.00215744,0.00129251,0.00520067,-0.00180495,0.0054
 7543,0.01506139,-0.00250677,0.00243915,0.00002626,-0.00007652,-0.00006
 164,-0.00003172,-0.00013702,-0.00051787,0.00006372,-0.00008816,-0.0003
 3643,0.00001642,0.00006167,0.00004996,0.00001327,-0.00002423,-0.000005
 94,0.00004242,0.00001413,0.00007751,0.00002812,0.00000069,-0.00000264,
 -0.00000703,-0.00000789,0.00002626,0.00000236,-0.00002303,-0.00000207,
 0.00000486,-0.00000470,-0.00001977,-0.00004760,-0.00002389,-0.00002714
 ,0.00003916,-0.00003205,-0.00002153,-0.00000884,0.00008489,0.00000525,
 0.00780935,0.03725165,-0.07541865,-0.02817968,-0.09321942,0.18028882,-
 0.01239131,-0.04699343,0.00989381,-0.27789779,-0.00699928,0.01652896,-
 0.00951694,0.00497522,-0.00002052,-0.00284087,-0.01726490,0.00281392,0
 .02217863,0.01140368,-0.00288549,-0.05079272,0.02513871,-0.00075638,-0
 .03793898,0.01990984,-0.00115162,-0.00010666,0.00021058,-0.00003309,0.
 00012934,0.00017650,-0.00003039,0.00119399,-0.00170526,0.00002263,0.00
 074216,-0.00031447,-0.00004477,-0.00043921,0.00008656,-0.00002767,0.00
 032301,0.00044276,0.00004496,-0.00015200,0.00007317,-0.00002364,0.0000
 8351,0.00004847,-0.00011481,-0.00014667,0.00005299,0.00014272,0.000023
 66,0.00001383,0.00002736,-0.00038858,-0.00035278,-0.00004193,-0.000585
 84,-0.00013993,-0.00032837,0.00024968,-0.00009850,0.00063628,0.0494725
 5,0.01776654,-0.00598607,-0.17844608,0.06108187,-0.00324371,0.65513778
 ,-0.03492247,0.01821689,0.00054712,-0.03317077,-0.10815952,0.01075643,
 0.00449119,-0.00819798,0.00199441,0.00123236,0.00755297,-0.00123384,-0
 .00696725,-0.00921730,0.00311280,0.04462645,-0.00292323,-0.00168318,0.
 02057339,-0.01240868,0.00037615,-0.00153409,-0.00009233,0.00012439,0.0
 0136426,-0.00011320,-0.00004274,0.00106279,0.00112258,-0.00080582,-0.0
 0041996,0.00049229,-0.00021902,0.00040316,-0.00009026,0.00013812,-0.00
 041498,-0.00068552,-0.00015013,-0.00004158,0.00000203,0.00001563,-0.00
 003187,0.00000843,0.00000173,0.00011423,0.00001281,-0.00015689,-0.0000
 4548,0.00000851,0.00003012,0.00049261,0.00047584,0.00004617,0.00039922
 ,0.00024438,0.00027671,-0.00021752,-0.00012008,-0.00048861,-0.01277819
 ,-0.04846031,0.01148539,0.11699625,-0.30213137,0.03482897,-0.00430470,
 0.73213684,0.00770490,0.00132553,0.00680902,0.02117077,0.00892291,-0.0
 6466766,0.00021146,0.00191344,0.00390569,-0.00010146,-0.00031064,-0.00
 089787,0.00016434,0.00197794,0.00549225,-0.00432549,-0.00026408,0.0052
 9012,-0.00123745,0.00041666,-0.00248099,0.00028438,0.00001268,0.000037
 59,-0.00026782,0.00002714,0.00014259,-0.00047969,-0.00062417,-0.002769
 83,0.00004518,-0.00020207,-0.00058888,-0.00001152,0.00006760,-0.000042
 19,0.00005440,-0.00000054,-0.00004980,0.00001886,0.00001794,0.00000231
 ,0.00001017,-0.00000215,-0.00001519,-0.00000764,0.00002220,0.00000243,
 0.00000877,0.00000553,0.00001351,-0.00012201,-0.00009275,0.00002040,-0
 .00007868,-0.00003654,0.00007280,0.00007608,0.00004460,0.00002463,-0.0
 0046043,0.00931394,0.00823332,-0.01337977,0.03878910,-0.07174768,-0.03
 655519,-0.11094942,0.14325819,-0.00628182,0.00175355,0.00004426,0.0065
 5346,0.00455507,-0.00064362,0.00340527,0.00001055,-0.00019646,-0.00219
 349,0.00192000,-0.00122795,-0.00073084,-0.00116356,0.00017817,-0.00212
 489,-0.00138411,0.00042544,0.00574618,-0.00324870,0.00038734,-0.000186
 17,-0.00030588,0.00007183,-0.00040391,0.00021541,-0.00001500,0.0001062
 7,0.00020991,-0.00004437,0.00083971,-0.00064001,0.00035454,-0.00092361
 ,0.00005776,-0.00048649,0.00157345,0.00176648,0.00054809,-0.00012380,0
 .00008703,-0.00006224,0.00010811,-0.00000794,-0.00001799,-0.00029068,-
 0.00008809,0.00038946,0.00014926,0.00002005,-0.00012333,-0.00160926,-0
 .00126203,-0.00016904,-0.00094197,-0.00052036,-0.00058350,0.00065630,0
 .00041679,0.00121309,-0.04978204,-0.01443154,0.00645821,-0.28085852,0.
 04033754,0.00904666,-0.04515675,0.01291214,0.00149551,0.50790242,-0.00
 147915,0.00255095,-0.00053266,-0.00391734,-0.00508048,0.00278647,0.001
 57835,-0.00014081,-0.00013801,-0.00013017,0.00182441,-0.00037832,-0.00
 168407,-0.00130865,0.00016200,0.00311577,-0.00079818,-0.00005530,0.003
 18616,-0.00774180,0.00173263,0.00013583,-0.00002858,-0.00000244,0.0000
 9805,0.00001569,-0.00001082,-0.00001757,0.00012395,0.00001412,0.000070
 26,0.00001577,0.00003905,-0.00005799,-0.00003140,-0.00004217,0.0001730
 0,0.00012245,0.00002922,-0.00002353,0.00001149,-0.00000930,0.00000777,
 0.00000643,0.00000205,-0.00002675,-0.00001330,0.00002713,0.00001794,0.
 00000442,-0.00001309,-0.00016099,-0.00008661,-0.00001461,-0.00009296,-
 0.00000611,-0.00002940,0.00007146,0.00001786,0.00010323,-0.04804770,0.
 00448067,0.00349140,0.00313648,-0.10955095,0.01141772,0.03904893,0.004
 15828,-0.00162132,0.07964500,0.35083087,0.00063135,-0.00076080,-0.0009
 1316,0.00086311,0.00219940,0.00821601,-0.00054609,-0.00004340,-0.00032
 324,0.00018658,-0.00043780,0.00027310,0.00028624,0.00015550,-0.0008773
 4,-0.00039283,0.00024180,0.00005762,-0.00074888,0.00219619,0.00278301,
 -0.00001157,0.00002768,0.00000347,0.00001317,-0.00001931,-0.00001592,0
 .00000890,-0.00000038,0.00019813,-0.00007744,0.00006249,0.00002058,0.0
 0007879,-0.00001264,0.00003598,-0.00012686,-0.00014091,-0.00010063,0.0
 0001283,-0.00001735,0.00000409,-0.00001131,-0.00000430,0.00000227,0.00
 002430,0.00000623,-0.00003068,-0.00001497,0.00000261,0.00001254,0.0001
 3735,0.00010520,0.00003549,0.00007010,0.00004784,0.00009193,-0.0000559
 3,-0.00003867,-0.00012884,0.01254756,0.00112253,0.00412548,0.01586452,
 0.00883032,-0.04841389,-0.00322912,0.00021551,0.01044341,-0.04497917,-
 0.05644756,0.08562135,0.00108102,-0.00001103,-0.00006546,-0.00124189,-
 0.00200069,0.00046885,-0.00072907,-0.00011444,0.00004431,0.00043633,-0
 .00034052,0.00024440,0.00008955,0.00006512,-0.00000339,0.00073626,0.00
 019595,-0.00010607,-0.00093189,-0.00150644,0.00042827,0.00001580,0.000
 07008,-0.00001264,0.00009278,-0.00004901,0.00000379,-0.00000715,-0.000
 06769,0.00002032,-0.00019400,0.00012694,-0.00006560,0.00018931,-0.0000
 0477,0.00009800,-0.00037888,-0.00037617,-0.00009081,0.00002734,-0.0000
 2086,0.00001398,-0.00002485,-0.00000335,0.00000485,0.00006607,0.000017
 29,-0.00007932,-0.00003457,-0.00000287,0.00002600,0.00037184,0.0002748
 4,0.00003156,0.00022905,0.00009696,0.00010292,-0.00015783,-0.00007649,
 -0.00025761,-0.00194162,0.00415664,-0.00039166,-0.04392484,-0.03775463
 ,0.00966244,0.00195781,-0.00045367,-0.00014084,-0.11102000,-0.03283304
 ,0.00950553,0.58226470,0.00121964,0.00053519,-0.00015456,-0.00218216,-
 0.00190390,0.00055064,-0.00074550,-0.00030847,0.00004571,0.00063844,-0
 .00024435,0.00032949,-0.00002516,0.00006694,0.00000739,0.00103596,0.00
 026426,-0.00015450,-0.00004271,0.00005704,0.00023048,0.00002485,0.0000
 8428,-0.00001156,0.00013178,-0.00007852,0.00000891,0.00000227,-0.00017
 235,0.00004661,-0.00027375,0.00018871,-0.00011143,0.00029388,-0.000007
 58,0.00015768,-0.00050071,-0.00053221,-0.00015708,0.00004982,-0.000033
 07,0.00002240,-0.00003553,-0.00000490,0.00001001,0.00009424,0.00002625
 ,-0.00012343,-0.00004921,-0.00000882,0.00003406,0.00050742,0.00037825,
 0.00005005,0.00031678,0.00013487,0.00018444,-0.00021756,-0.00010048,-0
 .00039771,0.00422328,0.00173279,-0.00002717,-0.01745702,0.00133673,0.0
 0018536,0.01009807,0.00252001,-0.00140067,-0.06420329,-0.18491249,0.02
 715006,-0.07135159,0.48832248,-0.00028192,-0.00006930,0.00017979,0.000
 51181,0.00054767,0.00021635,0.00016782,0.00001612,-0.00025804,-0.00014
 696,0.00007234,-0.00005523,0.00000129,-0.00000510,0.00004917,-0.000252
 21,-0.00009027,-0.00012428,0.00015144,0.00032096,0.00118152,-0.0000033
 2,-0.00001464,0.00003381,-0.00002937,0.00002128,0.00001870,0.00000407,
 0.00004766,0.00005216,0.00006010,-0.00005210,0.00002502,-0.00006437,0.
 00000724,-0.00002630,0.00008711,0.00014340,0.00012518,-0.00001167,0.00
 001046,-0.00000521,0.00000978,0.00000546,-0.00000126,-0.00002115,-0.00
 000555,0.00002608,0.00001204,-0.00000562,-0.00001232,-0.00010222,-0.00
 008964,-0.00004362,-0.00005001,-0.00004741,-0.00012086,0.00003882,0.00
 002774,0.00013030,-0.00041599,-0.00002269,0.00323267,0.00594871,0.0015
 9322,-0.00505955,-0.00207449,-0.00066137,-0.00103397,0.01526184,0.0249
 7139,-0.06649307,0.01183489,0.01904271,0.56075708,0.01077384,0.0146360
 0,-0.00312926,-0.00163403,0.00277059,-0.00009119,0.00117908,0.00113273
 ,-0.00048032,0.00008916,-0.00054454,0.00009118,0.00033017,0.00016913,-
 0.00005866,0.00039722,0.00076478,-0.00016166,-0.11753191,-0.10936118,0
 .02534034,-0.00013135,-0.00044510,0.00010297,-0.00001642,-0.00003087,0
 .00001011,-0.00013462,0.00024132,-0.00002322,-0.00003428,-0.00001039,0
 .00001563,0.00000851,0.00001455,0.00000572,-0.00005310,-0.00001394,-0.
 00004000,0.00002149,-0.00000826,0.00000150,-0.00000529,-0.00000098,0.0
 0001299,0.00000886,-0.00000192,-0.00000577,-0.00000107,-0.00001024,0.0
 0000118,0.00004321,0.00001349,0.00001575,0.00002383,-0.00000727,0.0000
 3029,-0.00000461,0.00000355,-0.00003363,-0.01101912,-0.02931668,0.0063
 0258,-0.00419762,0.00210935,0.00056014,-0.00059673,0.00032926,-0.00006
 745,-0.00100702,-0.00172117,0.00039956,-0.00024604,0.00032124,-0.00006
 356,0.12268170,-0.01409017,-0.01912030,0.00499122,0.00429052,-0.002300
 23,0.00093296,-0.00194312,0.00109460,-0.00057084,0.00033227,0.00003145
 ,-0.00003286,0.00010283,0.00016595,-0.00003601,-0.00133850,-0.00073505
 ,0.00024004,-0.10991125,-0.26529580,0.04895002,0.00113109,0.00032471,-
 0.00010069,0.00006661,0.00004158,-0.00000363,0.00023575,-0.00035527,0.
 00007978,-0.00001782,-0.00001533,0.00003735,0.00002200,-0.00003114,0.0
 0002359,-0.00001963,-0.00009761,-0.00002621,-0.00000539,0.00000908,-0.
 00000677,0.00001344,0.00001693,-0.00001332,0.00000249,0.00001229,-0.00
 001621,-0.00000276,0.00000365,0.00000842,0.00003667,0.00006729,-0.0000
 0308,-0.00000375,0.00006302,0.00000843,-0.00001912,-0.00007021,-0.0000
 1626,0.00110747,0.00300312,-0.00000684,0.00094905,0.00192768,0.0012662
 9,0.00063500,0.00030980,-0.00023625,-0.00022349,-0.00004825,0.00006410
 ,0.00011037,0.00012495,-0.00008620,0.11900695,0.28035863,0.00199149,0.
 00297581,0.00210544,-0.00034839,0.00104744,0.00445732,0.00008290,-0.00
 079533,-0.00257468,-0.00009038,0.00001856,-0.00013965,-0.00005159,-0.0
 0005236,-0.00006961,0.00022090,0.00009029,0.00004568,0.02545511,0.0489
 1305,-0.04625033,-0.00017642,0.00001441,0.00023838,-0.00000642,0.00000
 404,0.00004777,-0.00002200,0.00007668,0.00014886,0.00000828,0.00001834
 ,0.00010972,-0.00003155,-0.00001689,0.00001085,-0.00003708,0.00008736,
 0.00017960,0.00000274,0.00000367,-0.00000219,0.00001177,0.00001182,0.0
 0000751,-0.00000327,0.00000403,0.00000484,0.00000334,-0.00000863,-0.00
 000962,0.00002154,-0.00002369,-0.00005836,0.00005703,-0.00009715,-0.00
 013418,-0.00000374,0.00006719,0.00005181,0.00081043,0.00208531,0.00281
 246,0.00078115,0.00120777,0.00912484,-0.00012061,-0.00021998,-0.000734
 01,0.00012565,0.00017220,0.00018488,-0.00002454,-0.00010206,-0.0002871
 8,-0.02824436,-0.05429042,0.03656697,-0.00480206,-0.00192858,0.0013366
 2,-0.00070157,-0.00033572,0.00005191,0.00016766,0.00130463,-0.00021615
 ,-0.00049737,0.00012416,-0.00004731,-0.00019911,-0.00022624,0.00006058
 ,0.00033249,-0.00005950,-0.00004437,-0.01240929,0.02743254,-0.00393790
 ,-0.00001880,-0.00003936,0.00001895,-0.00000365,0.00001550,-0.00000369
 ,-0.00001760,0.00005851,-0.00000677,0.00000033,0.00010571,-0.00004173,
 -0.00002061,0.00000165,-0.00002029,0.00007226,0.00008786,0.00005721,-0
 .00005116,0.00000741,0.00000111,0.00000664,-0.00000165,0.00000024,-0.0
 0000862,-0.00000260,0.00001305,0.00000365,0.00000073,-0.00000271,-0.00
 005808,-0.00006012,-0.00001298,-0.00002054,-0.00002771,-0.00003456,0.0
 0001906,0.00001741,0.00004292,-0.14181128,0.12799955,-0.01561877,0.010
 33664,-0.01257453,0.00182188,-0.00124091,-0.00249325,0.00077543,0.0012
 6111,0.00039908,-0.00032468,0.00004226,-0.00005911,-0.00002387,0.00109
 825,-0.00034847,-0.00037104,0.14806131,-0.00130750,0.00174443,0.001478
 95,-0.00110304,0.00036139,-0.00012921,0.00012804,0.00003215,0.00004747
 ,0.00001937,0.00024865,-0.00014390,-0.00022902,-0.00008807,0.00005112,
 0.00027991,-0.00015386,-0.00007804,-0.00209748,0.00565980,-0.00043237,
 0.00001234,0.00000279,0.00003528,0.00001268,-0.00001008,-0.00000195,-0
 .00002374,0.00004412,0.00000170,-0.00002942,0.00002572,-0.00002129,0.0
 0002318,-0.00000470,0.00001102,-0.00002959,-0.00002770,-0.00000417,0.,
 -0.00000134,0.00000323,-0.00000309,0.00000105,0.00000364,0.00000602,0.
 00000149,-0.00000913,-0.00000255,-0.00000210,0.00000126,0.00003036,0.0
 0002045,0.00000142,0.00002244,0.00000579,0.00000935,-0.00001361,-0.000
 00241,-0.00002274,0.12653611,-0.25132253,0.03042365,0.01846134,-0.0191
 8907,0.00288368,-0.00374413,-0.00328751,0.00146082,0.00092228,0.002184
 88,-0.00088174,-0.00038375,0.00008760,-0.00007033,0.00027376,0.0006396
 9,-0.00106559,-0.13877658,0.26367633,0.00124116,0.00153433,0.00907324,
 0.00018795,-0.00019076,-0.00075733,-0.00000500,-0.00003291,0.00034281,
 -0.00000280,-0.00017760,-0.00062120,0.00007251,0.00006011,0.00012748,-
 0.00011422,-0.00005392,-0.00046542,0.00142955,-0.00250952,0.00277246,0
 .00001369,0.00003900,0.00019719,-0.00000352,-0.00000250,-0.00001702,0.
 00000871,-0.00000369,0.00004423,-0.00001426,-0.00002524,-0.00008078,0.
 00000785,-0.00000894,0.00001041,-0.00002719,0.00002380,0.00006152,-0.0
 0000385,0.00000029,0.00001202,-0.00000077,0.00000606,0.00000385,0.0000
 0010,0.00000704,-0.00000324,0.00000088,-0.00000378,-0.00000085,0.00001
 058,-0.00000767,-0.00002014,0.00001818,-0.00001615,-0.00004773,-0.0000
 1155,0.00000911,0.00002432,-0.01537971,0.03032188,-0.03856246,-0.00378
 591,0.00505747,0.00321643,0.00099490,0.00137312,0.00302267,-0.00041749
 ,-0.00084755,-0.00214760,0.00003557,-0.00009349,-0.00044149,-0.0004855
 2,-0.00101941,-0.00492207,0.01643208,-0.03363334,0.02901510,-0.0050487
 1,0.00184572,0.00035065,-0.01101911,-0.02830926,0.00605500,-0.00003494
 ,-0.00159936,0.00032736,0.00008039,-0.00000244,-0.00005877,0.00013007,
 0.00028235,-0.00007806,0.00151832,-0.00174684,0.00000251,-0.00066298,0
 .00054353,-0.00007484,-0.00048293,-0.00001213,0.00004325,-0.00000539,0
 .00001370,0.00001358,-0.00010746,0.00113218,-0.00018025,0.00003824,0.0
 0005932,0.00001187,-0.00002672,-0.00000450,-0.00001253,0.00003696,0.00
 001986,0.00002550,-0.00003403,0.00001003,-0.00000218,0.00000743,0.0000
 0589,-0.00001096,-0.00000779,0.00000038,0.00001042,0.00000153,0.000004
 09,0.00000024,-0.00002164,-0.00000998,-0.00000727,-0.00002165,-0.00000
 198,-0.00003463,0.00001421,-0.00000666,0.00005164,-0.00176175,0.002882
 53,-0.00001307,0.01333904,0.01359517,-0.00309289,-0.11381658,-0.109508
 45,0.02568712,-0.00029537,-0.00220811,0.00017584,-0.00238187,0.0016277
 6,-0.00015292,0.00005389,-0.00010897,-0.00004694,0.00040033,0.00084858
 ,-0.00016706,0.12283940,0.00059433,0.00161331,0.00051805,-0.00024461,0
 .00185364,0.00005271,0.00043252,-0.00019467,0.00007964,0.00007157,0.00
 043751,-0.00013196,-0.00056053,-0.00004290,-0.00001788,0.00167138,0.00
 072372,-0.00079232,0.00067638,0.00027546,-0.00015408,-0.00000356,-0.00
 000156,0.00002708,-0.00004521,0.00000600,0.00004128,-0.00043956,0.0003
 1457,0.00002157,0.00002532,-0.00000760,0.00001354,-0.00002319,-0.00000
 589,-0.00001425,0.00005854,0.00005325,0.00003927,-0.00000457,0.0000040
 5,-0.00000291,0.00000332,0.00000133,-0.00000050,-0.00000935,-0.0000027
 5,0.00001100,0.00000514,0.00000145,-0.00000573,-0.00005267,-0.00003700
 ,-0.00001367,-0.00002597,-0.00001372,-0.00003353,0.00001904,0.00001071
 ,0.00005002,0.00429786,-0.00258634,0.00118134,-0.01561030,-0.01880119,
 0.00536909,-0.10805617,-0.27158715,0.05134857,-0.00080544,0.00121406,-
 0.00081456,-0.00105409,-0.00071985,0.00014079,-0.00009338,-0.00007686,
 -0.00014481,-0.00079824,-0.00091860,0.00025755,0.12020167,0.28700596,0
 .00057174,0.00041605,0.00455700,0.00100001,0.00202849,0.00161931,-0.00
 004741,0.00022096,0.00038305,-0.00003443,-0.00010814,-0.00010772,0.000
 07323,-0.00006227,-0.00029925,-0.00061265,-0.00056739,-0.00285802,-0.0
 0010821,-0.00013665,-0.00026852,0.00004219,0.00002889,0.00013584,0.000
 02292,0.00003752,0.00020846,0.00010152,-0.00008444,0.00027921,0.000003
 40,-0.00000674,0.00004699,-0.00001292,0.00000429,0.00001305,-0.0000307
 6,-0.00000877,0.00005451,0.00000123,0.00000110,-0.00000114,-0.00000098
 ,0.00000672,-0.00000250,-0.00000200,0.00000528,-0.00000039,0.00000063,
 -0.00000565,-0.00000220,0.00003006,0.00001535,-0.00002066,0.00002425,-
 0.00001053,-0.00004741,-0.00001121,-0.00000114,0.00002472,-0.00027104,
 0.00127975,0.00533769,0.00223648,0.00331422,0.00398556,0.02540241,0.05
 146475,-0.04192981,-0.00008121,-0.00071156,-0.00341851,0.00033083,-0.0
 0005343,-0.00039891,-0.00005034,-0.00014119,-0.00088041,0.00013187,0.0
 0014405,0.00015897,-0.02888298,-0.05664349,0.03402277,-0.00019977,0.00
 053718,-0.00009217,-0.00081257,-0.00011554,-0.00052517,0.00020605,-0.0
 0007416,0.00008383,0.00000998,0.00024898,-0.00004560,-0.00024081,-0.00
 011731,0.00005269,0.00027611,-0.00020298,0.00005273,0.00070046,-0.0003
 4115,-0.00013262,0.00000499,-0.00000160,-0.00000790,0.00000142,-0.0000
 0621,-0.00000028,0.00000035,0.00000900,-0.00000006,-0.00000921,0.00001
 365,-0.00000482,0.00001210,-0.00000201,0.00000478,-0.00002302,-0.00002
 729,-0.00000974,0.00000294,-0.00000181,0.00000134,-0.00000222,-0.00000
 151,0.00000145,0.00000420,0.00000012,-0.00000488,-0.00000189,0.0000004
 2,0.00000097,0.00002252,0.00001776,0.00000361,0.00001607,0.00000520,0.
 00001186,-0.00001073,-0.00000035,-0.00001782,-0.00093980,-0.00065397,-
 0.00041498,0.00480348,-0.00080716,0.00172458,0.00042597,0.00128014,-0.
 00024747,0.00137972,-0.01409916,0.02048467,-0.07214876,0.02760751,-0.0
 6630240,0.00000402,0.00000512,0.00004988,0.00002746,0.00010831,0.00006
 537,-0.00127970,0.00013973,0.00146914,0.07145225,-0.00039450,0.0001788
 1,0.00001192,0.00007265,0.00010300,-0.00002446,0.00021648,-0.00001019,
 0.00001481,-0.00010731,0.00015130,-0.00008187,-0.00009940,-0.00008524,
 0.00000208,-0.00003354,-0.00006118,0.00001635,0.00037141,-0.00010302,-
 0.00020755,-0.00000772,-0.00001834,0.00000952,-0.00001978,0.00001282,-
 0.00000046,0.00001483,0.00000819,0.00000708,0.00004488,-0.00003156,0.0
 0001609,-0.00004680,-0.00000036,-0.00002449,0.00008251,0.00009612,0.00
 004522,-0.00000676,0.00000518,-0.00000352,0.00000593,0.00000063,-0.000
 00090,-0.00001573,-0.00000409,0.00001998,0.00000803,0.00000084,-0.0000
 0738,-0.00008461,-0.00006702,-0.00001486,-0.00004723,-0.00002912,-0.00
 004404,0.00003338,0.00002353,0.00007221,-0.00101142,-0.00062373,-0.000
 32643,0.00633169,0.00021904,-0.00001108,-0.00076667,0.00081913,-0.0004
 7233,-0.00505312,-0.02516498,0.02981756,0.02472899,-0.07934965,0.07543
 797,-0.00004001,-0.00001487,0.00005807,0.00007311,0.00016070,0.0001058
 2,0.00006000,0.00022882,-0.00003153,-0.02268122,0.09566123,0.00013793,
 -0.00005224,-0.00004783,-0.00012200,-0.00065096,0.00008585,-0.00017981
 ,-0.00005811,0.00003088,0.00009808,-0.00011266,0.00004881,0.00005127,0
 .00007665,-0.00000010,0.00006595,0.00008816,0.00001971,-0.00027796,0.0
 0001090,0.00006196,-0.00001761,0.00000284,-0.00001001,0.00000590,-0.00
 000467,-0.00000296,0.00001858,-0.00004136,-0.00002359,-0.00002171,0.00
 001341,-0.00001747,0.00002511,-0.00000312,0.00001178,-0.00001421,-0.00
 003938,-0.00003129,0.00000480,-0.00000239,0.00000212,-0.00000204,-0.00
 000069,-0.00000112,0.00000604,0.00000337,-0.00001021,-0.00000355,0.000
 00177,0.00000306,0.00002430,0.00002292,0.00001045,0.00001190,0.0000154
 9,0.00003398,-0.00000968,-0.00001037,-0.00003767,0.00070671,0.00019412
 ,-0.00018360,-0.00349384,0.00029731,0.00082194,0.00035639,0.00089698,-
 0.00027822,0.00712866,0.01003598,-0.00082921,-0.06214214,0.07845724,-0
 .25080962,0.00002633,0.00000471,-0.00000600,-0.00006085,-0.00011430,-0
 .00001560,0.00020289,-0.00082406,-0.00004736,0.06552152,-0.09428879,0.
 26893483,-0.00007336,-0.00005442,0.00001504,0.00016683,0.00004729,-0.0
 0000876,0.00005456,0.00001328,-0.00000871,-0.00003407,0.00002958,-0.00
 003438,-0.00002371,0.00001398,-0.00000497,-0.00006908,-0.00002694,0.00
 001297,-0.00002167,-0.00031743,0.00005703,-0.00000701,-0.00000980,0.00
 000202,-0.00001623,0.00001050,-0.00000090,0.00001065,0.00000271,-0.000
 00225,0.00003293,-0.00002445,0.00000749,-0.00003318,-0.00000057,-0.000
 01703,0.00008652,0.00007674,0.00001935,-0.00000531,0.00000483,-0.00000
 257,0.00000581,0.00000163,-0.00000222,-0.00001336,-0.00000209,0.000013
 97,0.00000716,0.00000069,-0.00000551,-0.00007949,-0.00005698,-0.000007
 37,-0.00004899,-0.00001678,-0.00001952,0.00003399,0.00001264,0.0000508
 5,-0.00089676,0.00034681,0.00002081,0.00207625,-0.00286848,0.00041609,
 0.00013689,-0.00008901,0.00004006,-0.02398252,-0.00350726,0.00235498,-
 0.29329407,0.07811817,0.00279416,-0.00009466,-0.00000248,0.00000351,0.
 00000941,-0.00002946,0.00000537,0.00007016,-0.00010090,-0.00002273,-0.
 00574456,0.00351311,-0.00023116,0.32394158,0.00004875,0.00006978,-0.00
 001697,-0.00018860,0.00062976,-0.00007228,0.00010210,0.00003995,-0.000
 01662,-0.00003419,0.00009286,-0.00002223,-0.00007506,-0.00004146,0.000
 01198,-0.00000658,-0.00009346,0.00002235,0.00017777,-0.00048032,0.0000
 7009,0.00001875,0.00000055,-0.00000247,-0.00000198,-0.00000053,-0.0000
 0049,-0.00001715,0.00002607,-0.00000517,0.00000422,0.00000152,0.000004
 35,-0.00000467,0.00000026,-0.00000327,-0.00000702,0.00000265,0.0000059
 7,-0.00000110,-0.00000035,-0.00000021,-0.00000034,-0.00000095,0.000000
 91,0.,-0.00000114,0.00000218,-0.00000023,0.00000028,-0.00000030,0.0000
 0285,-0.00000058,-0.00000116,0.00000336,-0.00000355,-0.00000669,-0.000
 00187,0.00000346,0.00000516,-0.00153207,0.00034870,0.00009727,-0.00120
 458,-0.00464760,0.00102418,0.00038048,-0.00113922,0.00026559,-0.041209
 40,0.00191096,0.00263561,0.09144346,-0.07396707,-0.00228998,-0.0001271
 6,-0.00000066,0.00000003,0.00003398,-0.00002731,0.00000414,0.00037848,
 0.00078708,-0.00026076,0.00998188,-0.00211449,-0.00166236,-0.07753397,
 0.08300518,-0.00000374,-0.00001024,-0.00000406,0.00003435,-0.00008926,
 0.00017404,-0.00002421,-0.00001249,-0.00002043,0.00000918,-0.00001791,
 0.00001277,0.00001537,0.00000617,-0.00000397,0.00000758,0.00002400,0.0
 0002149,-0.00003266,0.00010708,-0.00003354,-0.00000321,-0.00000044,-0.
 00000503,0.00000130,-0.00000129,-0.00000364,0.00000180,-0.00000649,-0.
 00000704,-0.00000377,0.00000119,-0.00000113,0.00000359,-0.00000034,0.0
 0000187,-0.00000559,-0.00000394,0.00000168,0.00000062,-0.00000018,0.00
 000012,-0.00000036,0.00000026,0.00000037,0.00000112,0.00000037,-0.0000
 0128,-0.00000066,-0.00000048,0.00000037,0.00000523,0.00000342,-0.00000
 096,0.00000376,0.00000064,-0.00000098,-0.00000161,-0.00000064,-0.00000
 364,0.00036345,-0.00003489,0.00027047,0.00010533,0.00113693,0.00026660
 ,-0.00004701,0.00029902,0.00042113,0.00924032,-0.00001208,-0.00016088,
 0.00036517,-0.00135433,-0.05101972,0.00002639,-0.00000871,-0.00005021,
 -0.00000635,0.00000841,0.00000651,-0.00011011,-0.00022796,-0.00045420,
 -0.02737949,0.00855068,0.00221914,-0.00536620,-0.00113691,0.04742031,-
 0.00020370,0.00053581,-0.00008024,-0.00070635,0.00017753,0.00060875,0.
 00020812,-0.00009374,-0.00007540,0.00000185,0.00026053,-0.00003063,-0.
 00024597,-0.00013014,0.00002055,0.00026193,-0.00022165,-0.00000492,0.0
 0073785,-0.00028525,0.00014611,0.00000881,0.00000067,0.00000603,0.0000
 0140,-0.00000550,0.00000177,-0.00000350,0.00001238,-0.00000757,-0.0000
 0894,0.00001272,-0.00000015,0.00001178,-0.00000326,0.00000486,-0.00002
 362,-0.00001807,0.00000012,0.00000233,-0.00000199,0.00000056,-0.000002
 50,-0.00000088,0.00000257,0.00000422,-0.00000089,-0.00000408,-0.000002
 28,-0.00000016,0.00000033,0.00002063,0.00001463,0.00000014,0.00001763,
 0.00000293,0.00000379,-0.00001048,0.00000054,-0.00001527,-0.00092504,-
 0.00045820,0.00071325,0.00482275,-0.00145991,-0.00186221,0.00039965,0.
 00111578,-0.00026454,-0.00176860,-0.02067710,-0.01312650,-0.05894280,0
 .03083219,0.03311254,-0.00000537,-0.00001272,-0.00004738,0.00002178,0.
 00008826,-0.00010558,-0.00152133,-0.00026907,-0.00127303,0.00206296,-0
 .00514120,-0.00781578,-0.00219468,0.01936991,0.02280041,0.05798147,-0.
 00041682,0.00015966,-0.00003309,0.00012849,0.00031996,-0.00009137,0.00
 025850,0.00000649,-0.00003172,-0.00013461,0.00017860,-0.00007443,-0.00
 010196,-0.00009623,0.00004361,-0.00006046,-0.00007763,0.00003308,0.000
 45225,-0.00002295,0.00016882,-0.00000240,-0.00002145,-0.00000502,-0.00
 002076,0.00001319,-0.00000283,0.00000454,0.00001473,-0.00002392,0.0000
 5129,-0.00003217,0.00001811,-0.00005306,0.00000082,-0.00002961,0.00009
 569,0.00009578,0.00001764,-0.00000743,0.00000511,-0.00000340,0.0000056
 8,-0.00000134,-0.00000137,-0.00001689,-0.00000566,0.00002280,0.0000085
 5,0.00000333,-0.00000659,-0.00009622,-0.00007085,-0.00000470,-0.000058
 75,-0.00002471,-0.00002159,0.00003999,0.00002150,0.00006585,-0.0011145
 4,-0.00048530,0.00059304,0.00699903,0.00005836,-0.00067633,-0.00080301
 ,0.00053286,0.00028077,-0.01028259,-0.03456057,-0.01526121,0.02711847,
 -0.15351666,-0.11889621,-0.00005361,-0.00003282,-0.00003914,0.00006985
 ,0.00013823,-0.00017322,0.00000747,0.00046517,-0.00013374,-0.00082156,
 0.01000852,0.00774362,0.00244904,-0.00440037,-0.00721962,-0.02364417,0
 .18132641,0.00003228,-0.00010166,-0.00002316,0.00018017,0.00054154,-0.
 00022854,0.00006636,0.00007910,0.00001524,-0.00005449,0.00001583,-0.00
 001814,0.00002225,-0.00002087,0.00001718,-0.00008107,-0.00001723,0.000
 05332,0.00002628,0.00005509,-0.00006206,0.00001699,0.00000089,-0.00001
 020,0.00000077,-0.00000054,-0.00000321,-0.00002574,0.00002561,-0.00002
 756,0.00000755,-0.00000007,0.00000796,-0.00000905,0.00000159,-0.000006
 48,-0.00000013,-0.00000220,-0.00002056,-0.00000206,-0.00000028,-0.0000
 0087,-0.00000046,-0.00000096,0.00000086,-0.00000085,-0.00000196,0.0000
 0361,0.00000051,0.00000088,0.00000141,-0.00000287,0.00000037,0.0000076
 2,-0.00000557,0.00000154,0.00001423,0.00000258,-0.00000010,-0.00000400
 ,-0.00021736,0.00000546,-0.00033696,0.00049709,0.00011520,0.00095640,-
 0.00014944,-0.00137252,0.00004404,-0.00332122,0.00588160,0.01174363,0.
 03015843,-0.12237180,-0.18983722,-0.00000772,0.00000801,0.00002156,0.0
 0003016,0.00004306,0.00001372,-0.00003241,0.00067019,-0.00009011,0.005
 65696,-0.01864565,-0.01993267,-0.00007942,0.00134808,0.00095383,-0.032
 70851,0.13374180,0.19674711\\0.00000274,-0.00000399,0.00000146,0.00000
 603,-0.00000058,-0.00000067,-0.00000632,-0.00000358,-0.00000324,-0.000
 00459,0.00000978,0.00000092,0.00000424,-0.00000080,-0.00000195,-0.0000
 0688,-0.00000006,0.00000055,-0.00000697,0.00000367,0.00000061,0.000000
 07,0.00000124,0.00000116,-0.00000102,-0.00000074,0.00000122,0.00000170
 ,-0.00000087,0.00000059,0.00001642,0.00000378,-0.00001376,0.00000838,0
 .00000027,0.00001531,-0.00003595,-0.00000898,0.00003125,-0.00000053,-0
 .00000228,0.00000229,-0.00000577,0.00000066,-0.00000326,-0.00000072,-0
 .00000125,0.00000512,-0.00000376,0.00000051,0.00000097,0.00002114,0.00
 000985,-0.00000818,0.00001245,-0.00000411,-0.00002731,0.00000033,-0.00
 000085,0.00000321,-0.00000193,0.00000643,-0.00000270,0.00001627,-0.000
 01281,-0.00000425,-0.00002227,0.00001019,0.00000067,-0.00001793,-0.000
 01784,0.00001162,0.00003232,0.00003167,-0.00001263,0.00000123,-0.00000
 002,-0.00000045,-0.00000009,-0.00000105,-0.00000076,-0.00000785,-0.000
 00403,0.00000114,-0.00000063,-0.00000558,0.00000290,-0.00000123,-0.000
 00149,-0.00000126,0.00000112,-0.00000715,-0.00000056\\\@


 REALITY IS FOR PEOPLE WHO CAN'T FACE SCIENCE FICTION.
 Job cpu time:       0 days  7 hours 32 minutes 33.7 seconds.
 Elapsed time:       0 days  0 hours 56 minutes 43.6 seconds.
 File lengths (MBytes):  RWF=    649 Int=      0 D2E=      0 Chk=     26 Scr=      2
 Normal termination of Gaussian 16 at Thu Aug 12 21:39:36 2021.
